ethyl 4-[(3-hydroxyphenyl)amino]-6,8-dimethyl-quinolin-1-ium-3-carboxylate chloride

Systemtic Name: ethyl 4-[(3-hydroxyphenyl)amino]-6,8-dimethyl-quinolin-1-ium-3-carboxylate chloride Openeye Name: ethyl 4-(3-hydroxyanilino)-6,8-dimethyl-quinolin-1-ium-3-carboxylate chloride CAS Name: 4-(3-hydroxyanilino)-6,8-dimethyl-3-quinolin-1-iumcarboxylic acid ethyl ester chloride IUPAC Name: ethyl 4-(3-hydroxyanilino)-6,8-dimethylquinolin-1-ium-3-carboxylate chloride Traditional Name: 4-(3-hydroxyanilino)-6,8-dimethyl-quinolin-1-ium-3-carboxylic acid ethyl ester chloride Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=CC(=C2[NH+]=C1)C)C)NC3=CC(=CC=C3)O.[Cl-]

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=CC(=C2[NH+]=C1)C)C)NC3=CC(=CC=C3)O.[Cl-]

InChI

InChI=1S/C20H20N2O3.ClH/c1-4-25-20(24)17-11-21-18-13(3)8-12(2)9-16(18)19(17)22-14-6-5-7-15(23)10-14;/h5-11,23H,4H2,1-3H3,(H,21,22);1H