[4-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl] 2-(1H-indol-3-yl)ethanoate

Systemtic Name: [4-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl] 2-(1H-indol-3-yl)ethanoate Openeye Name: [4-(4-benzylpiperazine-1-carbonyl)phenyl] 2-(1H-indol-3-yl)acetate CAS Name: 2-(1H-indol-3-yl)acetic acid [4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl] ester IUPAC Name: [4-(4-benzylpiperazine-1-carbonyl)phenyl] 2-(1H-indol-3-yl)acetate Traditional Name: 2-(1H-indol-3-yl)acetic acid [4-(4-benzylpiperazine-1-carbonyl)phenyl] ester Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OC(=O)CC4=CNC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OC(=O)CC4=CNC5=CC=CC=C54

InChI

InChI=1S/C28H27N3O3/c32-27(18-23-19-29-26-9-5-4-8-25(23)26)34-24-12-10-22(11-13-24)28(33)31-16-14-30(15-17-31)20-21-6-2-1-3-7-21/h1-13,19,29H,14-18,20H2