(E)-2-[1-(phenylmethyl)piperidin-4-yl]-3-pyridin-3-yl-hept-2-enamide

Systemtic Name: (E)-2-[1-(phenylmethyl)piperidin-4-yl]-3-pyridin-3-yl-hept-2-enamide Openeye Name: (E)-2-(1-benzyl-4-piperidyl)-3-(3-pyridyl)hept-2-enamide CAS Name: (E)-2-[1-(phenylmethyl)-4-piperidinyl]-3-(3-pyridinyl)-2-heptenamide IUPAC Name: (E)-2-(1-benzylpiperidin-4-yl)-3-pyridin-3-ylhept-2-enamide Traditional Name: (E)-2-(1-benzyl-4-piperidyl)-3-(3-pyridyl)hept-2-enamide Formula: C24H31N3O MolecularWeight: 377.52244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(C1CCN(CC1)CC2=CC=CC=C2)C(=O)N)C3=CN=CC=C3

Isomeric SMILES

CCCC/C(=C(/C1CCN(CC1)CC2=CC=CC=C2)\C(=O)N)/C3=CN=CC=C3

InChI

InChI=1S/C24H31N3O/c1-2-3-11-22(21-10-7-14-26-17-21)23(24(25)28)20-12-15-27(16-13-20)18-19-8-5-4-6-9-19/h4-10,14,17,20H,2-3,11-13,15-16,18H2,1H3,(H2,25,28)/b23-22+