[4,5-dimethoxy-3,6-bis(oxidanylidene)-2-phenylsulfanyl-cyclohexa-1,4-dien-1-yl]methyl N-methylcarbamate

Systemtic Name: [4,5-dimethoxy-3,6-bis(oxidanylidene)-2-phenylsulfanyl-cyclohexa-1,4-dien-1-yl]methyl N-methylcarbamate Openeye Name: (4,5-dimethoxy-3,6-dioxo-2-phenylsulfanyl-cyclohexa-1,4-dien-1-yl)methyl N-methylcarbamate CAS Name: N-methylcarbamic acid [4,5-dimethoxy-3,6-dioxo-2-(phenylthio)-1-cyclohexa-1,4-dienyl]methyl ester IUPAC Name: (4,5-dimethoxy-3,6-dioxo-2-phenylsulfanylcyclohexa-1,4-dien-1-yl)methyl N-methylcarbamate Traditional Name: N-methylcarbamic acid [3,6-diketo-4,5-dimethoxy-2-(phenylthio)cyclohexa-1,4-dien-1-yl]methyl ester Formula: C17H17NO6S MolecularWeight: 363.38498

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OCC1=C(C(=O)C(=C(C1=O)OC)OC)SC2=CC=CC=C2

Isomeric SMILES

CNC(=O)OCC1=C(C(=O)C(=C(C1=O)OC)OC)SC2=CC=CC=C2

InChI

InChI=1S/C17H17NO6S/c1-18-17(21)24-9-11-12(19)14(22-2)15(23-3)13(20)16(11)25-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,18,21)