(E)-1-[3-(hydroxymethyl)piperidin-1-yl]-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[3-(hydroxymethyl)piperidin-1-yl]-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[3-(hydroxymethyl)-1-piperidyl]-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one CAS Name: (E)-1-[3-(hydroxymethyl)-1-piperidinyl]-3-(2-methoxy-5-methylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[3-(hydroxymethyl)piperidin-1-yl]-3-(2-methoxy-5-methylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(2-methoxy-5-methyl-phenyl)-1-(3-methylolpiperidino)prop-2-en-1-one Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCC(C2)CO

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)N2CCCC(C2)CO

InChI

InChI=1S/C17H23NO3/c1-13-5-7-16(21-2)15(10-13)6-8-17(20)18-9-3-4-14(11-18)12-19/h5-8,10,14,19H,3-4,9,11-12H2,1-2H3/b8-6+