[4-[(Z)-2-(4-chlorophenyl)-2-cyano-ethenyl]-2-methoxy-phenyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [4-[(Z)-2-(4-chlorophenyl)-2-cyano-ethenyl]-2-methoxy-phenyl] 3-methyl-4-nitro-benzoate Openeye Name: [4-[(Z)-2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [4-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [4-[(Z)-2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C24H17ClN2O5 MolecularWeight: 448.85518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=C(C=C(C=C2)C=C(C#N)C3=CC=C(C=C3)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C3=CC=C(C=C3)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C24H17ClN2O5/c1-15-11-18(6-9-21(15)27(29)30)24(28)32-22-10-3-16(13-23(22)31-2)12-19(14-26)17-4-7-20(25)8-5-17/h3-13H,1-2H3/b19-12+