[5,5-dimethyl-3-oxidanylidene-2-[(E)-C-phenyl-N-prop-2-enoxy-carbonimidoyl]cyclohexen-1-yl] benzoate

Systemtic Name: [5,5-dimethyl-3-oxidanylidene-2-[(E)-C-phenyl-N-prop-2-enoxy-carbonimidoyl]cyclohexen-1-yl] benzoate Openeye Name: [2-[(E)-N-allyloxy-C-phenyl-carbonimidoyl]-5,5-dimethyl-3-oxo-cyclohexen-1-yl] benzoate CAS Name: benzoic acid [5,5-dimethyl-3-oxo-2-[(E)-phenyl(prop-2-enoxyimino)methyl]-1-cyclohexenyl] ester IUPAC Name: [5,5-dimethyl-3-oxo-2-[(E)-C-phenyl-N-prop-2-enoxycarbonimidoyl]cyclohexen-1-yl] benzoate Traditional Name: benzoic acid [2-[(E)-N-allyloxy-C-phenyl-carbonimidoyl]-3-keto-5,5-dimethyl-cyclohexen-1-yl] ester Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=NOCC=C)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)/C(=N/OCC=C)/C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C25H25NO4/c1-4-15-29-26-23(18-11-7-5-8-12-18)22-20(27)16-25(2,3)17-21(22)30-24(28)19-13-9-6-10-14-19/h4-14H,1,15-17H2,2-3H3/b26-23+