2-azanyl-N-[4-(3,5-dinitrophenyl)-2-methyl-4-oxidanylidene-butan-2-yl]-4-methyl-pentanamide

Systemtic Name: 2-azanyl-N-[4-(3,5-dinitrophenyl)-2-methyl-4-oxidanylidene-butan-2-yl]-4-methyl-pentanamide Openeye Name: 2-amino-N-[3-(3,5-dinitrophenyl)-1,1-dimethyl-3-oxo-propyl]-4-methyl-pentanamide CAS Name: 2-amino-N-[4-(3,5-dinitrophenyl)-2-methyl-4-oxobutan-2-yl]-4-methylpentanamide IUPAC Name: 2-amino-N-[4-(3,5-dinitrophenyl)-2-methyl-4-oxobutan-2-yl]-4-methylpentanamide Traditional Name: 2-amino-N-[3-(3,5-dinitrophenyl)-3-keto-1,1-dimethyl-propyl]-4-methyl-valeramide Formula: C17H24N4O6 MolecularWeight: 380.39566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N4O6/c1-10(2)5-14(18)16(23)19-17(3,4)9-15(22)11-6-12(20(24)25)8-13(7-11)21(26)27/h6-8,10,14H,5,9,18H2,1-4H3,(H,19,23)