4-[(E)-3-[2-(1,3-benzodioxol-5-yl)ethylamino]-3-oxidanylidene-prop-1-enyl]-N-methyl-benzamide

Systemtic Name: 4-[(E)-3-[2-(1,3-benzodioxol-5-yl)ethylamino]-3-oxidanylidene-prop-1-enyl]-N-methyl-benzamide Openeye Name: 4-[(E)-3-[2-(1,3-benzodioxol-5-yl)ethylamino]-3-oxo-prop-1-enyl]-N-methyl-benzamide CAS Name: 4-[(E)-3-[2-(1,3-benzodioxol-5-yl)ethylamino]-3-oxoprop-1-enyl]-N-methylbenzamide IUPAC Name: 4-[(E)-3-[2-(1,3-benzodioxol-5-yl)ethylamino]-3-oxoprop-1-enyl]-N-methylbenzamide Traditional Name: 4-[(E)-3-(homopiperonylamino)-3-keto-prop-1-enyl]-N-methyl-benzamide Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)C=CC(=O)NCCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)/C=C/C(=O)NCCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H20N2O4/c1-21-20(24)16-6-2-14(3-7-16)5-9-19(23)22-11-10-15-4-8-17-18(12-15)26-13-25-17/h2-9,12H,10-11,13H2,1H3,(H,21,24)(H,22,23)/b9-5+