methyl (2Z)-2-(4,5-dimethyl-2-phenylsulfanyl-cyclohexa-1,4-dien-1-yl)-2-methoxyimino-ethanoate

Systemtic Name: methyl (2Z)-2-(4,5-dimethyl-2-phenylsulfanyl-cyclohexa-1,4-dien-1-yl)-2-methoxyimino-ethanoate Openeye Name: methyl (2Z)-2-(4,5-dimethyl-2-phenylsulfanyl-cyclohexa-1,4-dien-1-yl)-2-methoxyimino-acetate CAS Name: (2Z)-2-[4,5-dimethyl-2-(phenylthio)-1-cyclohexa-1,4-dienyl]-2-methoxyiminoacetic acid methyl ester IUPAC Name: methyl (2Z)-2-(4,5-dimethyl-2-phenylsulfanylcyclohexa-1,4-dien-1-yl)-2-methoxyiminoacetate Traditional Name: (2Z)-2-[4,5-dimethyl-2-(phenylthio)cyclohexa-1,4-dien-1-yl]-2-methyloximino-acetic acid methyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(C1)C(=NOC)C(=O)OC)SC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(CC(=C(C1)/C(=N/OC)/C(=O)OC)SC2=CC=CC=C2)C

InChI

InChI=1S/C18H21NO3S/c1-12-10-15(17(19-22-4)18(20)21-3)16(11-13(12)2)23-14-8-6-5-7-9-14/h5-9H,10-11H2,1-4H3/b19-17-