[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate

Systemtic Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate Openeye Name: [2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl] 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid [2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl] 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid [2-(3,5-dimethylpiperidino)-2-keto-ethyl] ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)COC(=O)CCCC2=CNC3=CC=CC=C32)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)COC(=O)CCCC2=CNC3=CC=CC=C32)C

InChI

InChI=1S/C21H28N2O3/c1-15-10-16(2)13-23(12-15)20(24)14-26-21(25)9-5-6-17-11-22-19-8-4-3-7-18(17)19/h3-4,7-8,11,15-16,22H,5-6,9-10,12-14H2,1-2H3