[3-[[4-(cyclopropylamino)-3-nitro-phenyl]carbonylamino]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[[4-(cyclopropylamino)-3-nitro-phenyl]carbonylamino]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[[4-(cyclopropylamino)-3-nitro-benzoyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[[4-(cyclopropylamino)-3-nitrophenyl]-oxomethyl]amino]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[4-(cyclopropylamino)-3-nitrobenzoyl]amino]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[4-(cyclopropylamino)-3-nitro-benzoyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C17H27N4O3+ MolecularWeight: 335.42128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-])C[NH+](C)C

Isomeric SMILES

CC(C)(CNC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-])C[NH+](C)C

InChI

InChI=1S/C17H26N4O3/c1-17(2,11-20(3)4)10-18-16(22)12-5-8-14(19-13-6-7-13)15(9-12)21(23)24/h5,8-9,13,19H,6-7,10-11H2,1-4H3,(H,18,22)/p+1