1-[(3S)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-yl]-3-pyridin-3-yl-propan-1-one

Systemtic Name: 1-[(3S)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-yl]-3-pyridin-3-yl-propan-1-one Openeye Name: 1-[(3S)-3-[2-(3-methoxyphenyl)ethyl]-1-piperidyl]-3-(3-pyridyl)propan-1-one CAS Name: 1-[(3S)-3-[2-(3-methoxyphenyl)ethyl]-1-piperidinyl]-3-(3-pyridinyl)-1-propanone IUPAC Name: 1-[(3S)-3-[2-(3-methoxyphenyl)ethyl]piperidin-1-yl]-3-pyridin-3-ylpropan-1-one Traditional Name: 1-[(3S)-3-[2-(3-methoxyphenyl)ethyl]piperidino]-3-(3-pyridyl)propan-1-one Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCC2CCCN(C2)C(=O)CCC3=CN=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)CC[C@H]2CCCN(C2)C(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-26-21-8-2-5-18(15-21)9-10-20-7-4-14-24(17-20)22(25)12-11-19-6-3-13-23-16-19/h2-3,5-6,8,13,15-16,20H,4,7,9-12,14,17H2,1H3/t20-/m1/s1