3-(1H-indol-3-ylmethyl)-1-[2-(4-phenylmethoxyphenyl)ethyl]piperazin-2-one

Systemtic Name: 3-(1H-indol-3-ylmethyl)-1-[2-(4-phenylmethoxyphenyl)ethyl]piperazin-2-one Openeye Name: 1-[2-(4-benzyloxyphenyl)ethyl]-3-(1H-indol-3-ylmethyl)piperazin-2-one CAS Name: 3-(1H-indol-3-ylmethyl)-1-[2-(4-phenylmethoxyphenyl)ethyl]-2-piperazinone IUPAC Name: 3-(1H-indol-3-ylmethyl)-1-[2-(4-phenylmethoxyphenyl)ethyl]piperazin-2-one Traditional Name: 1-[2-(4-benzoxyphenyl)ethyl]-3-(1H-indol-3-ylmethyl)piperazin-2-one Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C(N1)CC2=CNC3=CC=CC=C32)CCC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(C(=O)C(N1)CC2=CNC3=CC=CC=C32)CCC4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2/c32-28-27(18-23-19-30-26-9-5-4-8-25(23)26)29-15-17-31(28)16-14-21-10-12-24(13-11-21)33-20-22-6-2-1-3-7-22/h1-13,19,27,29-30H,14-18,20H2