ethyl (3R)-3-(3-phenylpropyl)-1-(3-pyridin-4-ylpropanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-3-(3-phenylpropyl)-1-(3-pyridin-4-ylpropanoyl)piperidine-3-carboxylate Openeye Name: ethyl (3R)-3-(3-phenylpropyl)-1-[3-(4-pyridyl)propanoyl]piperidine-3-carboxylate CAS Name: (3R)-1-(1-oxo-3-pyridin-4-ylpropyl)-3-(3-phenylpropyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-(3-phenylpropyl)-1-(3-pyridin-4-ylpropanoyl)piperidine-3-carboxylate Traditional Name: (3R)-3-(3-phenylpropyl)-1-[3-(4-pyridyl)propanoyl]nipecotic acid ethyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CCC2=CC=NC=C2)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)C(=O)CCC2=CC=NC=C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C25H32N2O3/c1-2-30-24(29)25(15-6-10-21-8-4-3-5-9-21)16-7-19-27(20-25)23(28)12-11-22-13-17-26-18-14-22/h3-5,8-9,13-14,17-18H,2,6-7,10-12,15-16,19-20H2,1H3/t25-/m1/s1