N-[2,5-dimethoxy-4-[2-(4-nitroimidazol-1-yl)ethanoylamino]phenyl]benzamide

Systemtic Name: N-[2,5-dimethoxy-4-[2-(4-nitroimidazol-1-yl)ethanoylamino]phenyl]benzamide Openeye Name: N-[2,5-dimethoxy-4-[[2-(4-nitroimidazol-1-yl)acetyl]amino]phenyl]benzamide CAS Name: N-[2,5-dimethoxy-4-[[2-(4-nitro-1-imidazolyl)-1-oxoethyl]amino]phenyl]benzamide IUPAC Name: N-[2,5-dimethoxy-4-[[2-(4-nitroimidazol-1-yl)acetyl]amino]phenyl]benzamide Traditional Name: N-[2,5-dimethoxy-4-[[2-(4-nitroimidazol-1-yl)acetyl]amino]phenyl]benzamide Formula: C20H19N5O6 MolecularWeight: 425.39476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O6/c1-30-16-9-15(23-20(27)13-6-4-3-5-7-13)17(31-2)8-14(16)22-19(26)11-24-10-18(21-12-24)25(28)29/h3-10,12H,11H2,1-2H3,(H,22,26)(H,23,27)