ethyl (2E,4Z)-5-(4-chlorophenyl)-2-cyano-5-(4-phenylpiperazin-1-yl)penta-2,4-dienoate

Systemtic Name: ethyl (2E,4Z)-5-(4-chlorophenyl)-2-cyano-5-(4-phenylpiperazin-1-yl)penta-2,4-dienoate Openeye Name: ethyl (2E,4Z)-5-(4-chlorophenyl)-2-cyano-5-(4-phenylpiperazin-1-yl)penta-2,4-dienoate CAS Name: (2E,4Z)-5-(4-chlorophenyl)-2-cyano-5-(4-phenyl-1-piperazinyl)penta-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2E,4Z)-5-(4-chlorophenyl)-2-cyano-5-(4-phenylpiperazin-1-yl)penta-2,4-dienoate Traditional Name: (2E,4Z)-5-(4-chlorophenyl)-2-cyano-5-(4-phenylpiperazino)penta-2,4-dienoic acid ethyl ester Formula: C24H24ClN3O2 MolecularWeight: 421.91926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC=C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C=C(/C1=CC=C(C=C1)Cl)\N2CCN(CC2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C24H24ClN3O2/c1-2-30-24(29)20(18-26)10-13-23(19-8-11-21(25)12-9-19)28-16-14-27(15-17-28)22-6-4-3-5-7-22/h3-13H,2,14-17H2,1H3/b20-10+,23-13-