[2,2-dimethyl-3-[[2-nitro-4-(phenylcarbonyl)phenyl]amino]propyl]-dimethyl-azanium

Systemtic Name: [2,2-dimethyl-3-[[2-nitro-4-(phenylcarbonyl)phenyl]amino]propyl]-dimethyl-azanium Openeye Name: [3-(4-benzoyl-2-nitro-anilino)-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-(4-benzoyl-2-nitroanilino)-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-(4-benzoyl-2-nitroanilino)-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-(4-benzoyl-2-nitro-anilino)-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C20H26N3O3+ MolecularWeight: 356.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-])C[NH+](C)C

Isomeric SMILES

CC(C)(CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-])C[NH+](C)C

InChI

InChI=1S/C20H25N3O3/c1-20(2,14-22(3)4)13-21-17-11-10-16(12-18(17)23(25)26)19(24)15-8-6-5-7-9-15/h5-12,21H,13-14H2,1-4H3/p+1