2-[[2-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylamino]phenyl]carbonylamino]ethyl-dimethyl-azanium chloride

Systemtic Name: 2-[[2-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylamino]phenyl]carbonylamino]ethyl-dimethyl-azanium chloride Openeye Name: 2-[[2-[(4-bromo-3-methoxy-naphthalene-2-carbonyl)amino]benzoyl]amino]ethyl-dimethyl-ammonium chloride CAS Name: 2-[[[2-[[(4-bromo-3-methoxy-2-naphthalenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]ethyl-dimethylammonium chloride IUPAC Name: 2-[[2-[(4-bromo-3-methoxynaphthalene-2-carbonyl)amino]benzoyl]amino]ethyl-dimethylazanium chloride Traditional Name: 2-[[2-[(4-bromo-3-methoxy-2-naphthoyl)amino]benzoyl]amino]ethyl-dimethyl-ammonium chloride Formula: C23H25BrClN3O3 MolecularWeight: 506.8199

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br.[Cl-]

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br.[Cl-]

InChI

InChI=1S/C23H24BrN3O3.ClH/c1-27(2)13-12-25-22(28)17-10-6-7-11-19(17)26-23(29)18-14-15-8-4-5-9-16(15)20(24)21(18)30-3;/h4-11,14H,12-13H2,1-3H3,(H,25,28)(H,26,29);1H