3-[(3R)-1-(2-methylphenyl)carbonylpiperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(3R)-1-(2-methylphenyl)carbonylpiperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[(3R)-1-(2-methylbenzoyl)-3-piperidyl]-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-[(3R)-1-[(2-methylphenyl)-oxomethyl]-3-piperidinyl]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[(3R)-1-(2-methylbenzoyl)piperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(3R)-1-o-toluoyl-3-piperidyl]-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCCC(C2)CCC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC[C@@H](C2)CCC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C25H32N4O2/c1-20-7-2-3-9-22(20)25(31)29-14-6-8-21(19-29)11-12-24(30)28-17-15-27(16-18-28)23-10-4-5-13-26-23/h2-5,7,9-10,13,21H,6,8,11-12,14-19H2,1H3/t21-/m1/s1