[2-[(Z)-C-ethyl-N-prop-2-enoxy-carbonimidoyl]-3-oxidanylidene-5-[(E)-2-phenylethenyl]cyclohexen-1-yl] benzoate

Systemtic Name: [2-[(Z)-C-ethyl-N-prop-2-enoxy-carbonimidoyl]-3-oxidanylidene-5-[(E)-2-phenylethenyl]cyclohexen-1-yl] benzoate Openeye Name: [2-[(Z)-N-allyloxy-C-ethyl-carbonimidoyl]-3-oxo-5-[(E)-styryl]cyclohexen-1-yl] benzoate CAS Name: benzoic acid [3-oxo-5-[(E)-2-phenylethenyl]-2-[(1Z)-1-prop-2-enoxyiminopropyl]-1-cyclohexenyl] ester IUPAC Name: [2-[(Z)-C-ethyl-N-prop-2-enoxycarbonimidoyl]-3-oxo-5-[(E)-2-phenylethenyl]cyclohexen-1-yl] benzoate Traditional Name: benzoic acid [2-[(Z)-N-allyloxy-C-ethyl-carbonimidoyl]-3-keto-5-[(E)-styryl]cyclohexen-1-yl] ester Formula: C27H27NO4 MolecularWeight: 429.50758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NOCC=C)C1=C(CC(CC1=O)C=CC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C27H27NO4/c1-3-17-31-28-23(4-2)26-24(29)18-21(16-15-20-11-7-5-8-12-20)19-25(26)32-27(30)22-13-9-6-10-14-22/h3,5-16,21H,1,4,17-19H2,2H3/b16-15+,28-23-