cyclohexyl-[[2-[[4-(dimethylamino)-3-nitro-phenyl]carbonylamino]phenyl]methyl]-methyl-azanium

Systemtic Name: cyclohexyl-[[2-[[4-(dimethylamino)-3-nitro-phenyl]carbonylamino]phenyl]methyl]-methyl-azanium Openeye Name: cyclohexyl-[[2-[[4-(dimethylamino)-3-nitro-benzoyl]amino]phenyl]methyl]-methyl-ammonium CAS Name: cyclohexyl-[[2-[[[4-(dimethylamino)-3-nitrophenyl]-oxomethyl]amino]phenyl]methyl]-methylammonium IUPAC Name: cyclohexyl-[[2-[[4-(dimethylamino)-3-nitrobenzoyl]amino]phenyl]methyl]-methylazanium Traditional Name: cyclohexyl-[2-[[4-(dimethylamino)-3-nitro-benzoyl]amino]benzyl]-methyl-ammonium Formula: C23H31N4O3+ MolecularWeight: 411.51724

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-])C3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-])C3CCCCC3

InChI

InChI=1S/C23H30N4O3/c1-25(2)21-14-13-17(15-22(21)27(29)30)23(28)24-20-12-8-7-9-18(20)16-26(3)19-10-5-4-6-11-19/h7-9,12-15,19H,4-6,10-11,16H2,1-3H3,(H,24,28)/p+1