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

Systemtic Name: N-methyl-4-[[methyl-[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoyl]amino]methyl]benzamide Openeye Name: N-methyl-4-[[methyl-[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoyl]amino]methyl]benzamide CAS Name: N-methyl-4-[[methyl-[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-1-oxoprop-2-enyl]amino]methyl]benzamide IUPAC Name: N-methyl-4-[[methyl-[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoyl]amino]methyl]benzamide Traditional Name: N-methyl-4-[[methyl-[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acryloyl]amino]methyl]benzamide Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O6/c1-22-21(26)15-5-3-14(4-6-15)11-23(2)19(25)8-7-16-9-18(24(27)28)10-17-12-29-13-30-20(16)17/h3-10H,11-13H2,1-2H3,(H,22,26)/b8-7+