(E)-3-(1,3-benzodioxol-5-yl)-1-[3-(hydroxymethyl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[3-(hydroxymethyl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[3-(hydroxymethyl)-1-piperidyl]prop-2-en-1-one CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[3-(hydroxymethyl)-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[3-(hydroxymethyl)piperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(3-methylolpiperidino)prop-2-en-1-one Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CC3=C(C=C2)OCO3)CO

Isomeric SMILES

C1CC(CN(C1)C(=O)/C=C/C2=CC3=C(C=C2)OCO3)CO

InChI

InChI=1S/C16H19NO4/c18-10-13-2-1-7-17(9-13)16(19)6-4-12-3-5-14-15(8-12)21-11-20-14/h3-6,8,13,18H,1-2,7,9-11H2/b6-4+