skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > cinnamate ester > 6-amino-5-cyano-2-(4-methoxyphenyl)-4-(3-pyridinyl)-4h-pyran-3-carboxylic acid ethyl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > cinnamate ester > 6-amino-5-cyano-2-(4-methoxyphenyl)-4-(3-pyridinyl)-4h-pyran-3-carboxylic acid ethyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > cinnamate ester > 6-amino-5-cyano-2-(4-methoxyphenyl)-4-(3-pyridinyl)-4h-pyran-3-carboxylic acid ethyl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > enoate ester > cinnamate ester > 6-amino-5-cyano-2-(4-methoxyphenyl)-4-(3-pyridinyl)-4h-pyran-3-carboxylic acid ethyl ester

Preferred term

6-amino-5-cyano-2-(4-methoxyphenyl)-4-(3-pyridinyl)-4h-pyran-3-carboxylic acid ethyl ester  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C21H19N3O4

inchi

  • InChI=1S/C21H19N3O4/c1-3-27-21(25)18-17(14-5-4-10-24-12-14)16(11-22)20(23)28-19(18)13-6-8-15(26-2)9-7-13/h4-10,12,17H,3,23H2,1-2H3

inchikey

  • STLFPMADNKLVFJ-UHFFFAOYSA-N

mass

  • 377.394

monoisotopicmass

  • 377.13756

smiles

  • CCOC(=O)C1=C(OC(=C(C1C2=CN=CC=C2)C#N)N)C3=CC=C(C=C3)OC

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:107378

Download this concept:

RDF/XML TURTLE JSON-LD