ethyl 4-[3-(1H-indol-3-yl)-3-(3-methylphenyl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(1H-indol-3-yl)-3-(3-methylphenyl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(1H-indol-3-yl)-3-(m-tolyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(1H-indol-3-yl)-3-(3-methylphenyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(1H-indol-3-yl)-3-(3-methylphenyl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(1H-indol-3-yl)-3-(m-tolyl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC(C2=CC=CC(=C2)C)C3=CNC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CC(C2=CC=CC(=C2)C)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H29N3O3/c1-3-31-25(30)28-13-11-27(12-14-28)24(29)16-21(19-8-6-7-18(2)15-19)22-17-26-23-10-5-4-9-20(22)23/h4-10,15,17,21,26H,3,11-14,16H2,1-2H3