(E)-N-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-N-methyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-N-methyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-N-methyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-[(4,5-dimethoxy-2-methylphenyl)methyl]-N-methyl-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-[(4,5-dimethoxy-2-methylphenyl)methyl]-N-methyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(4,5-dimethoxy-2-methyl-benzyl)-N-methyl-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C21H22N2O7 MolecularWeight: 414.40858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN(C)C(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN(C)C(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)OC)OC

InChI

InChI=1S/C21H22N2O7/c1-13-7-17(27-3)18(28-4)9-15(13)11-22(2)21(24)6-5-14-8-19-20(30-12-29-19)10-16(14)23(25)26/h5-10H,11-12H2,1-4H3/b6-5+