(E)-1-(4-methoxy-2-oxidanyl-phenyl)-3-[4-(phenylmethyl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-methoxy-2-oxidanyl-phenyl)-3-[4-(phenylmethyl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-benzyl-1-piperidyl)-1-(2-hydroxy-4-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(2-hydroxy-4-methoxyphenyl)-3-[4-(phenylmethyl)-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-benzylpiperidin-1-yl)-1-(2-hydroxy-4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-benzylpiperidino)-1-(2-hydroxy-4-methoxy-phenyl)prop-2-en-1-one Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=CN2CCC(CC2)CC3=CC=CC=C3)O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)/C=C/N2CCC(CC2)CC3=CC=CC=C3)O

InChI

InChI=1S/C22H25NO3/c1-26-19-7-8-20(22(25)16-19)21(24)11-14-23-12-9-18(10-13-23)15-17-5-3-2-4-6-17/h2-8,11,14,16,18,25H,9-10,12-13,15H2,1H3/b14-11+