ethyl (3S)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperidine-3-carboxylate CAS Name: (3S)-1-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]nipecotic acid ethyl ester Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC2=CC=CN2C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)CC2=CC=CN2C3=CN=CC=C3

InChI

InChI=1S/C18H23N3O2/c1-2-23-18(22)15-6-4-10-20(13-15)14-17-8-5-11-21(17)16-7-3-9-19-12-16/h3,5,7-9,11-12,15H,2,4,6,10,13-14H2,1H3/t15-/m0/s1