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

Systemtic Name: [2-[(E)-C-ethyl-N-phenylmethoxy-carbonimidoyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] benzoate Openeye Name: [2-[(E)-N-benzyloxy-C-ethyl-carbonimidoyl]-5,5-dimethyl-3-oxo-cyclohexen-1-yl] benzoate CAS Name: benzoic acid [5,5-dimethyl-3-oxo-2-[(1E)-1-phenylmethoxyiminopropyl]-1-cyclohexenyl] ester IUPAC Name: [2-[(E)-C-ethyl-N-phenylmethoxycarbonimidoyl]-5,5-dimethyl-3-oxocyclohexen-1-yl] benzoate Traditional Name: benzoic acid [2-[(E)-N-benzoxy-C-ethyl-carbonimidoyl]-3-keto-5,5-dimethyl-cyclohexen-1-yl] ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NOCC1=CC=CC=C1)C2=C(CC(CC2=O)(C)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC/C(=N\OCC1=CC=CC=C1)/C2=C(CC(CC2=O)(C)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H27NO4/c1-4-20(26-29-17-18-11-7-5-8-12-18)23-21(27)15-25(2,3)16-22(23)30-24(28)19-13-9-6-10-14-19/h5-14H,4,15-17H2,1-3H3/b26-20+