[2-[phenyl-(4-phenylpiperazin-1-yl)amino]phenyl] 2-methylbutanoate

Systemtic Name: [2-[phenyl-(4-phenylpiperazin-1-yl)amino]phenyl] 2-methylbutanoate Openeye Name: [2-(N-(4-phenylpiperazin-1-yl)anilino)phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-(N-(4-phenyl-1-piperazinyl)anilino)phenyl] ester IUPAC Name: [2-(N-(4-phenylpiperazin-1-yl)anilino)phenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-(N-(4-phenylpiperazino)anilino)phenyl] ester Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC1=CC=CC=C1N(C2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC(C)C(=O)OC1=CC=CC=C1N(C2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c1-3-22(2)27(31)32-26-17-11-10-16-25(26)30(24-14-8-5-9-15-24)29-20-18-28(19-21-29)23-12-6-4-7-13-23/h4-17,22H,3,18-21H2,1-2H3