3-methyl-3-[5-[(2-methyl-3-oxidanylidene-butan-2-yl)amino]pentylamino]-1-(2-nitroimidazol-1-yl)butan-2-one

Systemtic Name: 3-methyl-3-[5-[(2-methyl-3-oxidanylidene-butan-2-yl)amino]pentylamino]-1-(2-nitroimidazol-1-yl)butan-2-one Openeye Name: 3-[5-[(1,1-dimethyl-2-oxo-propyl)amino]pentylamino]-3-methyl-1-(2-nitroimidazol-1-yl)butan-2-one CAS Name: 3-methyl-3-[5-[(2-methyl-3-oxobutan-2-yl)amino]pentylamino]-1-(2-nitro-1-imidazolyl)-2-butanone IUPAC Name: 3-methyl-3-[5-[(2-methyl-3-oxobutan-2-yl)amino]pentylamino]-1-(2-nitroimidazol-1-yl)butan-2-one Traditional Name: 3-[5-[(2-keto-1,1-dimethyl-propyl)amino]pentylamino]-3-methyl-1-(2-nitroimidazol-1-yl)butan-2-one Formula: C18H31N5O4 MolecularWeight: 381.46984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)NCCCCCNC(C)(C)C(=O)CN1C=CN=C1[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(C)(C)NCCCCCNC(C)(C)C(=O)CN1C=CN=C1[N+](=O)[O-]

InChI

InChI=1S/C18H31N5O4/c1-14(24)17(2,3)20-9-7-6-8-10-21-18(4,5)15(25)13-22-12-11-19-16(22)23(26)27/h11-12,20-21H,6-10,13H2,1-5H3