N-methyl-4-[[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoyl]amino]benzamide

Systemtic Name: N-methyl-4-[[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoyl]amino]benzamide Openeye Name: N-methyl-4-[[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoyl]amino]benzamide CAS Name: N-methyl-4-[[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]benzamide IUPAC Name: N-methyl-4-[[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoyl]amino]benzamide Traditional Name: N-methyl-4-[[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)acryloyl]amino]benzamide Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C18H15N3O6/c1-19-18(23)11-2-5-13(6-3-11)20-17(22)7-4-12-8-15-16(27-10-26-15)9-14(12)21(24)25/h2-9H,10H2,1H3,(H,19,23)(H,20,22)/b7-4+