[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium Openeye Name: (2-anilino-2-oxo-ethyl)-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (2-anilino-2-oxoethyl)-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (2-anilino-2-oxoethyl)-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: (2-anilino-2-keto-ethyl)-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C18H21BrN3O2+ MolecularWeight: 391.28224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H20BrN3O2/c1-13-10-14(19)8-9-16(13)21-18(24)12-22(2)11-17(23)20-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,20,23)(H,21,24)/p+1