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

Systemtic Name: (4-bromophenyl)methyl-[2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[2-(2-chloro-4-nitroanilino)-2-oxoethyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[2-(2-chloro-4-nitroanilino)-2-oxoethyl]-methylazanium Traditional Name: (4-bromobenzyl)-[2-(2-chloro-4-nitro-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C16H16BrClN3O3+ MolecularWeight: 413.67354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrClN3O3/c1-20(9-11-2-4-12(17)5-3-11)10-16(22)19-15-7-6-13(21(23)24)8-14(15)18/h2-8H,9-10H2,1H3,(H,19,22)/p+1