[2-[(Z)-C-ethyl-N-(methylsulfanylmethoxy)carbonimidoyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] benzoate

Systemtic Name: [2-[(Z)-C-ethyl-N-(methylsulfanylmethoxy)carbonimidoyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] benzoate Openeye Name: [2-[(Z)-C-ethyl-N-(methylsulfanylmethoxy)carbonimidoyl]-5,5-dimethyl-3-oxo-cyclohexen-1-yl] benzoate CAS Name: benzoic acid [5,5-dimethyl-2-[(1Z)-1-[(methylthio)methoxyimino]propyl]-3-oxo-1-cyclohexenyl] ester IUPAC Name: [2-[(Z)-C-ethyl-N-(methylsulfanylmethoxy)carbonimidoyl]-5,5-dimethyl-3-oxocyclohexen-1-yl] benzoate Traditional Name: benzoic acid [2-[(Z)-C-ethyl-N-[(methylthio)methoxy]carbonimidoyl]-3-keto-5,5-dimethyl-cyclohexen-1-yl] ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NOCSC)C1=C(CC(CC1=O)(C)C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO4S/c1-5-15(21-24-13-26-4)18-16(22)11-20(2,3)12-17(18)25-19(23)14-9-7-6-8-10-14/h6-10H,5,11-13H2,1-4H3/b21-15-