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

Systemtic Name: (E)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Openeye Name: (E)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide CAS Name: (E)-N-[(1-methyl-2-imidazolyl)-phenylmethyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenamide IUPAC Name: (E)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Traditional Name: (E)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylamide Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C=CC3=CC(=CC4=C3OCOC4)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)/C=C/C3=CC(=CC4=C3OCOC4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O5/c1-25-10-9-23-22(25)20(15-5-3-2-4-6-15)24-19(27)8-7-16-11-18(26(28)29)12-17-13-30-14-31-21(16)17/h2-12,20H,13-14H2,1H3,(H,24,27)/b8-7+