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

Systemtic Name: (4-bromophenyl)methyl-methyl-[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[2-(2-methyl-4-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[2-(2-methyl-4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[2-(2-methyl-4-nitroanilino)-2-oxoethyl]azanium Traditional Name: (4-bromobenzyl)-[2-keto-2-(2-methyl-4-nitro-anilino)ethyl]-methyl-ammonium Formula: C17H19BrN3O3+ MolecularWeight: 393.25506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H18BrN3O3/c1-12-9-15(21(23)24)7-8-16(12)19-17(22)11-20(2)10-13-3-5-14(18)6-4-13/h3-9H,10-11H2,1-2H3,(H,19,22)/p+1