(E,4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-oxidanylpiperidin-1-yl)hex-2-en-1-one

Systemtic Name: (E,4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-oxidanylpiperidin-1-yl)hex-2-en-1-one Openeye Name: (E,4E)-4-(1,3-benzodioxol-5-ylmethylene)-1-(4-hydroxy-1-piperidyl)hex-2-en-1-one CAS Name: (E,4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-hydroxy-1-piperidinyl)-2-hexen-1-one IUPAC Name: (E,4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-hydroxypiperidin-1-yl)hex-2-en-1-one Traditional Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-4-ethyl-1-(4-hydroxypiperidino)penta-2,4-dien-1-one Formula: C19H23NO4 MolecularWeight: 329.39022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC2=C(C=C1)OCO2)C=CC(=O)N3CCC(CC3)O

Isomeric SMILES

CC/C(=C\C1=CC2=C(C=C1)OCO2)/C=C/C(=O)N3CCC(CC3)O

InChI

InChI=1S/C19H23NO4/c1-2-14(4-6-19(22)20-9-7-16(21)8-10-20)11-15-3-5-17-18(12-15)24-13-23-17/h3-6,11-12,16,21H,2,7-10,13H2,1H3/b6-4+,14-11+