ethyl 1-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-[2-(2-pyridyl)-1H-indol-3-yl]butanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-4-[2-(2-pyridinyl)-1H-indol-3-yl]butyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[2-(2-pyridyl)-1H-indol-3-yl]butanoyl]isonipecotic acid ethyl ester Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCCC2=C(NC3=CC=CC=C32)C4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCCC2=C(NC3=CC=CC=C32)C4=CC=CC=N4

InChI

InChI=1S/C25H29N3O3/c1-2-31-25(30)18-13-16-28(17-14-18)23(29)12-7-9-20-19-8-3-4-10-21(19)27-24(20)22-11-5-6-15-26-22/h3-6,8,10-11,15,18,27H,2,7,9,12-14,16-17H2,1H3