skip to main content

Chemistry, part 1

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfonic acid derivative > 1-[(5-chloro-1-naphthalenyl)sulfonyl]-1,4-diazepane
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfonic acid derivative > 1-[(5-chloro-1-naphthalenyl)sulfonyl]-1,4-diazepane

Preferred term

1-[(5-chloro-1-naphthalenyl)sulfonyl]-1,4-diazepane  

Type

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

Broader concept

charge

  • 0

formula

  • C15H17ClN2O2S

inchi

  • InChI=1S/C15H17ClN2O2S/c16-14-6-1-5-13-12(14)4-2-7-15(13)21(19,20)18-10-3-8-17-9-11-18/h1-2,4-7,17H,3,8-11H2

inchikey

  • OZSMSRIUUDGTEP-UHFFFAOYSA-N

mass

  • 324.827

monoisotopicmass

  • 324.06993

smiles

  • C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CC=C3Cl

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:93202

Download this concept:

RDF/XML TURTLE JSON-LD