[2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-methylphenyl)methyl]azanium

Systemtic Name: [2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-methylphenyl)methyl]azanium Openeye Name: [2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl]-methyl-(o-tolylmethyl)ammonium CAS Name: [2-(2-chloro-4-nitroanilino)-2-oxoethyl]-methyl-[(2-methylphenyl)methyl]ammonium IUPAC Name: [2-(2-chloro-4-nitroanilino)-2-oxoethyl]-methyl-[(2-methylphenyl)methyl]azanium Traditional Name: [2-(2-chloro-4-nitro-anilino)-2-keto-ethyl]-methyl-(2-methylbenzyl)ammonium Formula: C17H19ClN3O3+ MolecularWeight: 348.80406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H18ClN3O3/c1-12-5-3-4-6-13(12)10-20(2)11-17(22)19-16-8-7-14(21(23)24)9-15(16)18/h3-9H,10-11H2,1-2H3,(H,19,22)/p+1