4-methyl-4-[3-[(2-methyl-3-oxidanylidene-butan-2-yl)amino]propylamino]-1-(2-nitroimidazol-1-yl)pentane-1,3-dione

Systemtic Name: 4-methyl-4-[3-[(2-methyl-3-oxidanylidene-butan-2-yl)amino]propylamino]-1-(2-nitroimidazol-1-yl)pentane-1,3-dione Openeye Name: 4-[3-[(1,1-dimethyl-2-oxo-propyl)amino]propylamino]-4-methyl-1-(2-nitroimidazol-1-yl)pentane-1,3-dione CAS Name: 4-methyl-4-[3-[(2-methyl-3-oxobutan-2-yl)amino]propylamino]-1-(2-nitro-1-imidazolyl)pentane-1,3-dione IUPAC Name: 4-methyl-4-[3-[(2-methyl-3-oxobutan-2-yl)amino]propylamino]-1-(2-nitroimidazol-1-yl)pentane-1,3-dione Traditional Name: 4-[3-[(2-keto-1,1-dimethyl-propyl)amino]propylamino]-4-methyl-1-(2-nitroimidazol-1-yl)pentane-1,3-dione Formula: C17H27N5O5 MolecularWeight: 381.42678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)NCCCNC(C)(C)C(=O)CC(=O)N1C=CN=C1[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(C)(C)NCCCNC(C)(C)C(=O)CC(=O)N1C=CN=C1[N+](=O)[O-]

InChI

InChI=1S/C17H27N5O5/c1-12(23)16(2,3)19-7-6-8-20-17(4,5)13(24)11-14(25)21-10-9-18-15(21)22(26)27/h9-10,19-20H,6-8,11H2,1-5H3