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

Systemtic Name: ethyl 4-[3-(1-methylindol-3-yl)-3-(4-methylphenyl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(1-methylindol-3-yl)-3-(p-tolyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(1-methyl-3-indolyl)-3-(4-methylphenyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(1-methylindol-3-yl)-3-(4-methylphenyl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(1-methylindol-3-yl)-3-(p-tolyl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC(C2=CC=C(C=C2)C)C3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CC(C2=CC=C(C=C2)C)C3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C26H31N3O3/c1-4-32-26(31)29-15-13-28(14-16-29)25(30)17-22(20-11-9-19(2)10-12-20)23-18-27(3)24-8-6-5-7-21(23)24/h5-12,18,22H,4,13-17H2,1-3H3