ethyl 3-[3-[2-(3-chlorophenyl)-2-cyano-ethenyl]-2,5-dimethyl-pyrrol-1-yl]benzoate

Systemtic Name: ethyl 3-[3-[2-(3-chlorophenyl)-2-cyano-ethenyl]-2,5-dimethyl-pyrrol-1-yl]benzoate Openeye Name: ethyl 3-[3-[2-(3-chlorophenyl)-2-cyano-vinyl]-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 3-[3-[2-(3-chlorophenyl)-2-cyanoethenyl]-2,5-dimethyl-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-[2-(3-chlorophenyl)-2-cyanoethenyl]-2,5-dimethylpyrrol-1-yl]benzoate Traditional Name: 3-[3-[2-(3-chlorophenyl)-2-cyano-vinyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid ethyl ester Formula: C24H21ClN2O2 MolecularWeight: 404.88874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=C2C)C=C(C#N)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=C2C)C=C(C#N)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C24H21ClN2O2/c1-4-29-24(28)19-8-6-10-23(14-19)27-16(2)11-20(17(27)3)12-21(15-26)18-7-5-9-22(25)13-18/h5-14H,4H2,1-3H3