methyl 4-[N-(2-chlorophenyl)-C-(4-phenylpiperazin-1-yl)carbonimidoyl]benzoate

Systemtic Name: methyl 4-[N-(2-chlorophenyl)-C-(4-phenylpiperazin-1-yl)carbonimidoyl]benzoate Openeye Name: methyl 4-[N-(2-chlorophenyl)-C-(4-phenylpiperazin-1-yl)carbonimidoyl]benzoate CAS Name: 4-[(2-chlorophenyl)imino-(4-phenyl-1-piperazinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[N-(2-chlorophenyl)-C-(4-phenylpiperazin-1-yl)carbonimidoyl]benzoate Traditional Name: 4-[N-(2-chlorophenyl)-C-(4-phenylpiperazino)carbonimidoyl]benzoic acid methyl ester Formula: C25H24ClN3O2 MolecularWeight: 433.92996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=NC2=CC=CC=C2Cl)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=NC2=CC=CC=C2Cl)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H24ClN3O2/c1-31-25(30)20-13-11-19(12-14-20)24(27-23-10-6-5-9-22(23)26)29-17-15-28(16-18-29)21-7-3-2-4-8-21/h2-14H,15-18H2,1H3