3-chloranyl-5-diazo-1,4-diethoxy-2-(4-methylphenyl)sulfanyl-cyclohexa-1,3-diene

Systemtic Name: 3-chloranyl-5-diazo-1,4-diethoxy-2-(4-methylphenyl)sulfanyl-cyclohexa-1,3-diene Openeye Name: 3-chloro-5-diazo-1,4-diethoxy-2-(p-tolylsulfanyl)cyclohexa-1,3-diene CAS Name: 3-chloro-5-diazo-1,4-diethoxy-2-[(4-methylphenyl)thio]cyclohexa-1,3-diene IUPAC Name: 3-chloro-5-diazo-1,4-diethoxy-2-(4-methylphenyl)sulfanylcyclohexa-1,3-diene Traditional Name: 3-chloro-5-diazo-1,4-diethoxy-2-(p-tolylthio)cyclohexa-1,3-diene Formula: C17H19ClN2O2S MolecularWeight: 350.86296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=[N+]=[N-])C1)OCC)Cl)SC2=CC=C(C=C2)C

Isomeric SMILES

CCOC1=C(C(=C(C(=[N+]=[N-])C1)OCC)Cl)SC2=CC=C(C=C2)C

InChI

InChI=1S/C17H19ClN2O2S/c1-4-21-14-10-13(20-19)16(22-5-2)15(18)17(14)23-12-8-6-11(3)7-9-12/h6-9H,4-5,10H2,1-3H3