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

Systemtic Name: [2-[[[4-(cyclopropylamino)-3-nitro-phenyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[4-(cyclopropylamino)-3-nitro-benzoyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[[4-(cyclopropylamino)-3-nitrophenyl]-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[4-(cyclopropylamino)-3-nitrobenzoyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[4-(cyclopropylamino)-3-nitro-benzoyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C20H25N4O3+ MolecularWeight: 369.4375

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3/c1-23(2)13-16-6-4-3-5-15(16)12-21-20(25)14-7-10-18(22-17-8-9-17)19(11-14)24(26)27/h3-7,10-11,17,22H,8-9,12-13H2,1-2H3,(H,21,25)/p+1