(E,4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-piperidin-1-yl-oct-2-en-1-one

Systemtic Name: (E,4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-piperidin-1-yl-oct-2-en-1-one Openeye Name: (E,4E)-4-(1,3-benzodioxol-5-ylmethylene)-1-(1-piperidyl)oct-2-en-1-one CAS Name: (E,4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(1-piperidinyl)-2-octen-1-one IUPAC Name: (E,4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-piperidin-1-yloct-2-en-1-one Traditional Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-4-butyl-1-piperidino-penta-2,4-dien-1-one Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC1=CC2=C(C=C1)OCO2)C=CC(=O)N3CCCCC3

Isomeric SMILES

CCCC/C(=C\C1=CC2=C(C=C1)OCO2)/C=C/C(=O)N3CCCCC3

InChI

InChI=1S/C21H27NO3/c1-2-3-7-17(9-11-21(23)22-12-5-4-6-13-22)14-18-8-10-19-20(15-18)25-16-24-19/h8-11,14-15H,2-7,12-13,16H2,1H3/b11-9+,17-14+