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

Systemtic Name: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-nitrophenyl)methyl]azanium Openeye Name: [2-(2-bromoanilino)-2-oxo-ethyl]-methyl-[(4-nitrophenyl)methyl]ammonium CAS Name: [2-(2-bromoanilino)-2-oxoethyl]-methyl-[(4-nitrophenyl)methyl]ammonium IUPAC Name: [2-(2-bromoanilino)-2-oxoethyl]-methyl-[(4-nitrophenyl)methyl]azanium Traditional Name: [2-(2-bromoanilino)-2-keto-ethyl]-methyl-(4-nitrobenzyl)ammonium Formula: C16H17BrN3O3+ MolecularWeight: 379.22848

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C16H16BrN3O3/c1-19(10-12-6-8-13(9-7-12)20(22)23)11-16(21)18-15-5-3-2-4-14(15)17/h2-9H,10-11H2,1H3,(H,18,21)/p+1