2-[1-(phenylmethyl)piperidin-4-yl]-1-pyridin-4-yl-butan-1-one

Systemtic Name: 2-[1-(phenylmethyl)piperidin-4-yl]-1-pyridin-4-yl-butan-1-one Openeye Name: 2-(1-benzyl-4-piperidyl)-1-(4-pyridyl)butan-1-one CAS Name: 2-[1-(phenylmethyl)-4-piperidinyl]-1-pyridin-4-yl-1-butanone IUPAC Name: 2-(1-benzylpiperidin-4-yl)-1-pyridin-4-ylbutan-1-one Traditional Name: 2-(1-benzyl-4-piperidyl)-1-(4-pyridyl)butan-1-one Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCN(CC1)CC2=CC=CC=C2)C(=O)C3=CC=NC=C3

Isomeric SMILES

CCC(C1CCN(CC1)CC2=CC=CC=C2)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C21H26N2O/c1-2-20(21(24)19-8-12-22-13-9-19)18-10-14-23(15-11-18)16-17-6-4-3-5-7-17/h3-9,12-13,18,20H,2,10-11,14-16H2,1H3