4-[[[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)acryloyl]-methyl-amino]methyl]-N-methyl-benzamide Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C)C(=O)C=CC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN2O4/c1-22-20(25)15-6-3-13(4-7-15)11-23(2)18(24)8-5-14-9-16(21)19-17(10-14)26-12-27-19/h3-10H,11-12H2,1-2H3,(H,22,25)/b8-5+