N-(2-methyl-5-nitro-phenyl)-N'-[(2R)-1-oxidanylbutan-2-yl]ethanediamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-N'-[(2R)-1-oxidanylbutan-2-yl]ethanediamide Openeye Name: N'-[(1R)-1-(hydroxymethyl)propyl]-N-(2-methyl-5-nitro-phenyl)oxamide CAS Name: N'-[(2R)-1-hydroxybutan-2-yl]-N-(2-methyl-5-nitrophenyl)oxamide IUPAC Name: N'-[(2R)-1-hydroxybutan-2-yl]-N-(2-methyl-5-nitrophenyl)oxamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-N'-[(1R)-1-methylolpropyl]oxamide Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C

Isomeric SMILES

CC[C@H](CO)NC(=O)C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C

InChI

InChI=1S/C13H17N3O5/c1-3-9(7-17)14-12(18)13(19)15-11-6-10(16(20)21)5-4-8(11)2/h4-6,9,17H,3,7H2,1-2H3,(H,14,18)(H,15,19)/t9-/m1/s1