N-(4-methyl-3-nitro-phenyl)-N'-(1-oxidanylpropan-2-yl)ethanediamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-N'-(1-oxidanylpropan-2-yl)ethanediamide Openeye Name: N'-(2-hydroxy-1-methyl-ethyl)-N-(4-methyl-3-nitro-phenyl)oxamide CAS Name: N'-(1-hydroxypropan-2-yl)-N-(4-methyl-3-nitrophenyl)oxamide IUPAC Name: N'-(1-hydroxypropan-2-yl)-N-(4-methyl-3-nitrophenyl)oxamide Traditional Name: N'-(2-hydroxy-1-methyl-ethyl)-N-(4-methyl-3-nitro-phenyl)oxamide Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=O)NC(C)CO)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=O)NC(C)CO)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O5/c1-7-3-4-9(5-10(7)15(19)20)14-12(18)11(17)13-8(2)6-16/h3-5,8,16H,6H2,1-2H3,(H,13,17)(H,14,18)