4-[(8-bromanyl-2-methyl-quinolin-4-yl)amino]benzoic acid hydrochloride

Systemtic Name: 4-[(8-bromanyl-2-methyl-quinolin-4-yl)amino]benzoic acid hydrochloride Openeye Name: 4-[(8-bromo-2-methyl-4-quinolyl)amino]benzoic acid hydrochloride CAS Name: 4-[(8-bromo-2-methyl-4-quinolinyl)amino]benzoic acid hydrochloride IUPAC Name: 4-[(8-bromo-2-methylquinolin-4-yl)amino]benzoic acid hydrochloride Traditional Name: 4-[(8-bromo-2-methyl-4-quinolyl)amino]benzoic acid hydrochloride Formula: C17H14BrClN2O2 MolecularWeight: 393.66226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2Br)C(=C1)NC3=CC=C(C=C3)C(=O)O.Cl

Isomeric SMILES

CC1=NC2=C(C=CC=C2Br)C(=C1)NC3=CC=C(C=C3)C(=O)O.Cl

InChI

InChI=1S/C17H13BrN2O2.ClH/c1-10-9-15(13-3-2-4-14(18)16(13)19-10)20-12-7-5-11(6-8-12)17(21)22;/h2-9H,1H3,(H,19,20)(H,21,22);1H