methyl 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxidanylidene-piperidin-3-yl]propanoate

Systemtic Name: methyl 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxidanylidene-piperidin-3-yl]propanoate Openeye Name: methyl 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxo-3-piperidyl]propanoate CAS Name: 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxo-3-piperidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxopiperidin-3-yl]propanoate Traditional Name: 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-keto-3-piperidyl]propionic acid methyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCN(C1=O)CCC2=CNC3=CC=CC=C32)CCC(=O)OC

Isomeric SMILES

CC[C@]1(CCCN(C1=O)CCC2=CNC3=CC=CC=C32)CCC(=O)OC

InChI

InChI=1S/C21H28N2O3/c1-3-21(12-9-19(24)26-2)11-6-13-23(20(21)25)14-10-16-15-22-18-8-5-4-7-17(16)18/h4-5,7-8,15,22H,3,6,9-14H2,1-2H3/t21-/m0/s1