2-methyl-N-(3-methylbutanoyl)-5-nitro-pyridine-3-carboxamide

Systemtic Name: 2-methyl-N-(3-methylbutanoyl)-5-nitro-pyridine-3-carboxamide Openeye Name: 2-methyl-N-(3-methylbutanoyl)-5-nitro-pyridine-3-carboxamide CAS Name: 2-methyl-N-(3-methyl-1-oxobutyl)-5-nitro-3-pyridinecarboxamide IUPAC Name: 2-methyl-N-(3-methylbutanoyl)-5-nitropyridine-3-carboxamide Traditional Name: N-isovaleryl-2-methyl-5-nitro-nicotinamide Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C(=O)NC(=O)CC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1C(=O)NC(=O)CC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O4/c1-7(2)4-11(16)14-12(17)10-5-9(15(18)19)6-13-8(10)3/h5-7H,4H2,1-3H3,(H,14,16,17)