(E)-N-[(4-dimethylaminophenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide

Systemtic Name: (E)-N-[(4-dimethylaminophenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Openeye Name: (E)-N-[(4-dimethylaminophenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide CAS Name: (E)-N-[(4-dimethylaminophenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenamide IUPAC Name: (E)-N-[(4-dimethylaminophenyl)methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Traditional Name: (E)-N-[4-(dimethylamino)benzyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C=CC2=CC(=CC3=C2OCOC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)/C=C/C2=CC(=CC3=C2OCOC3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5/c1-22(2)17-6-3-14(4-7-17)11-21-19(24)8-5-15-9-18(23(25)26)10-16-12-27-13-28-20(15)16/h3-10H,11-13H2,1-2H3,(H,21,24)/b8-5+