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

Systemtic Name: methyl 4-[N-phenyl-C-(4-phenylpiperazin-1-yl)carbonimidoyl]benzoate Openeye Name: methyl 4-[N-phenyl-C-(4-phenylpiperazin-1-yl)carbonimidoyl]benzoate CAS Name: 4-[phenylimino-(4-phenyl-1-piperazinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[N-phenyl-C-(4-phenylpiperazin-1-yl)carbonimidoyl]benzoate Traditional Name: 4-[N-phenyl-C-(4-phenylpiperazino)carbonimidoyl]benzoic acid methyl ester Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=NC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=NC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O2/c1-30-25(29)21-14-12-20(13-15-21)24(26-22-8-4-2-5-9-22)28-18-16-27(17-19-28)23-10-6-3-7-11-23/h2-15H,16-19H2,1H3