1-[4-(phenylmethyl)piperidin-1-yl]-3-[1-(3-pyridin-4-ylpropanoyl)piperidin-4-yl]propan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-3-[1-(3-pyridin-4-ylpropanoyl)piperidin-4-yl]propan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-3-[1-[3-(4-pyridyl)propanoyl]-4-piperidyl]propan-1-one CAS Name: 3-[1-(1-oxo-3-pyridin-4-ylpropyl)-4-piperidinyl]-1-[4-(phenylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-[1-(3-pyridin-4-ylpropanoyl)piperidin-4-yl]propan-1-one Traditional Name: 1-(4-benzylpiperidino)-3-[1-[3-(4-pyridyl)propanoyl]-4-piperidyl]propan-1-one Formula: C28H37N3O2 MolecularWeight: 447.61228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)CCC4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1CCC(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)CCC4=CC=NC=C4

InChI

InChI=1S/C28H37N3O2/c32-27(8-6-23-10-16-29-17-11-23)30-18-12-24(13-19-30)7-9-28(33)31-20-14-26(15-21-31)22-25-4-2-1-3-5-25/h1-5,10-11,16-17,24,26H,6-9,12-15,18-22H2