1-[(3S)-3-(4-methoxy-2-methyl-phenyl)carbonylpiperidin-1-yl]-3-pyridin-3-yl-propan-1-one

Systemtic Name: 1-[(3S)-3-(4-methoxy-2-methyl-phenyl)carbonylpiperidin-1-yl]-3-pyridin-3-yl-propan-1-one Openeye Name: 1-[(3S)-3-(4-methoxy-2-methyl-benzoyl)-1-piperidyl]-3-(3-pyridyl)propan-1-one CAS Name: 1-[(3S)-3-[(4-methoxy-2-methylphenyl)-oxomethyl]-1-piperidinyl]-3-(3-pyridinyl)-1-propanone IUPAC Name: 1-[(3S)-3-(4-methoxy-2-methylbenzoyl)piperidin-1-yl]-3-pyridin-3-ylpropan-1-one Traditional Name: 1-[(3S)-3-(4-methoxy-2-methyl-benzoyl)piperidino]-3-(3-pyridyl)propan-1-one Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2CCCN(C2)C(=O)CCC3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)[C@H]2CCCN(C2)C(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-16-13-19(27-2)8-9-20(16)22(26)18-6-4-12-24(15-18)21(25)10-7-17-5-3-11-23-14-17/h3,5,8-9,11,13-14,18H,4,6-7,10,12,15H2,1-2H3/t18-/m0/s1