(E)-3-oxidanyl-1-(1-phenethylpiperidin-2-yl)-3-pyridin-3-yl-prop-2-en-1-one

Systemtic Name: (E)-3-oxidanyl-1-(1-phenethylpiperidin-2-yl)-3-pyridin-3-yl-prop-2-en-1-one Openeye Name: (E)-3-hydroxy-1-(1-phenethyl-2-piperidyl)-3-(3-pyridyl)prop-2-en-1-one CAS Name: (E)-3-hydroxy-1-(1-phenethyl-2-piperidinyl)-3-(3-pyridinyl)-2-propen-1-one IUPAC Name: (E)-3-hydroxy-1-(1-phenethylpiperidin-2-yl)-3-pyridin-3-ylprop-2-en-1-one Traditional Name: (E)-3-hydroxy-1-(1-phenethyl-2-piperidyl)-3-(3-pyridyl)prop-2-en-1-one Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)C=C(C2=CN=CC=C2)O)CCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)/C=C(\C2=CN=CC=C2)/O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2/c24-20(18-9-6-12-22-16-18)15-21(25)19-10-4-5-13-23(19)14-11-17-7-2-1-3-8-17/h1-3,6-9,12,15-16,19,24H,4-5,10-11,13-14H2/b20-15+