[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate CAS Name: (E)-2-(4-chlorophenyl)-3-phenyl-2-propenoic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] (E)-2-(4-chlorophenyl)-3-phenylprop-2-enoate Traditional Name: (E)-2-(4-chlorophenyl)-3-phenyl-acrylic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C24H23ClN2O3 MolecularWeight: 422.90402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)C(=CC2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)/C(=C/C2=CC=CC=C2)/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H23ClN2O3/c25-20-11-9-19(10-12-20)21(15-18-7-3-1-4-8-18)23(29)30-16-22(28)27-24(17-26)13-5-2-6-14-24/h1,3-4,7-12,15H,2,5-6,13-14,16H2,(H,27,28)/b21-15+