[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(3-oxidanylidene-3-phenylazanyl-propyl)azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(3-oxidanylidene-3-phenylazanyl-propyl)azanium Openeye Name: (3-anilino-3-oxo-propyl)-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (3-anilino-3-oxopropyl)-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (3-anilino-3-oxopropyl)-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: (3-anilino-3-keto-propyl)-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C19H23BrN3O2+ MolecularWeight: 405.30882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22BrN3O2/c1-14-12-15(20)8-9-17(14)22-19(25)13-23(2)11-10-18(24)21-16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,21,24)(H,22,25)/p+1