1-bromanyl-6-diazo-2,5-diethoxy-3-(4-methylphenyl)sulfanyl-cyclohexa-1,3-diene

Systemtic Name: 1-bromanyl-6-diazo-2,5-diethoxy-3-(4-methylphenyl)sulfanyl-cyclohexa-1,3-diene Openeye Name: 1-bromo-6-diazo-2,5-diethoxy-3-(p-tolylsulfanyl)cyclohexa-1,3-diene CAS Name: 1-bromo-6-diazo-2,5-diethoxy-3-[(4-methylphenyl)thio]cyclohexa-1,3-diene IUPAC Name: 1-bromo-6-diazo-2,5-diethoxy-3-(4-methylphenyl)sulfanylcyclohexa-1,3-diene Traditional Name: 1-bromo-6-diazo-2,5-diethoxy-3-(p-tolylthio)cyclohexa-1,3-diene Formula: C17H19BrN2O2S MolecularWeight: 395.31396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C=C(C(=C(C1=[N+]=[N-])Br)OCC)SC2=CC=C(C=C2)C

Isomeric SMILES

CCOC1C=C(C(=C(C1=[N+]=[N-])Br)OCC)SC2=CC=C(C=C2)C

InChI

InChI=1S/C17H19BrN2O2S/c1-4-21-13-10-14(23-12-8-6-11(3)7-9-12)17(22-5-2)15(18)16(13)20-19/h6-10,13H,4-5H2,1-3H3