skip to main content

Chemistry, part 2

Content language

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

Concept information

organooxygen compound > ether > aromatic ether > lsm-21547
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic ether > lsm-21547
... > 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 > aromatic ether > lsm-21547
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > lsm-21547

Preferred term

lsm-21547  

Type

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

Broader concept

charge

  • 0

formula

  • C25H32N4O4

inchi

  • InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/t17-,18-,22+/m1/s1

inchikey

  • QZTHWNUUUJWOTB-HMFYCAOWSA-N

mass

  • 452.547

monoisotopicmass

  • 452.24236

smiles

  • CC=CC1=CN=C2C(=C1)C(=O)N(C[C@H]([C@@H](O2)CN(C)C(=O)CC3=CC=CC=N3)C)[C@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:110120

Download this concept:

RDF/XML TURTLE JSON-LD