(2,4-dimethylphenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2,4-dimethylphenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (2,4-dimethylphenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: (2,4-dimethylphenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (2,4-dimethylphenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]azanium Traditional Name: (2,4-dimethylbenzyl)-[2-keto-2-(4-nitroanilino)ethyl]-methyl-ammonium Formula: C18H22N3O3+ MolecularWeight: 328.38558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+](C)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+](C)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O3/c1-13-4-5-15(14(2)10-13)11-20(3)12-18(22)19-16-6-8-17(9-7-16)21(23)24/h4-10H,11-12H2,1-3H3,(H,19,22)/p+1