ethanol; ethyl 8-methoxy-4-[(2-methylphenyl)methylamino]quinoline-3-carboxylate; hydrochloride

Systemtic Name: ethanol; ethyl 8-methoxy-4-[(2-methylphenyl)methylamino]quinoline-3-carboxylate; hydrochloride Openeye Name: ethanol; ethyl 8-methoxy-4-(o-tolylmethylamino)quinoline-3-carboxylate; hydrochloride CAS Name: ethanol; 8-methoxy-4-[(2-methylphenyl)methylamino]-3-quinolinecarboxylic acid ethyl ester; hydrochloride IUPAC Name: ethanol; ethyl 8-methoxy-4-[(2-methylphenyl)methylamino]quinoline-3-carboxylate; hydrochloride Traditional Name: ethanol; 8-methoxy-4-[(2-methylbenzyl)amino]quinoline-3-carboxylic acid ethyl ester; hydrochloride Formula: C23H29ClN2O4 MolecularWeight: 432.94036

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CCOC(=O)C1=CN=C2C(=C1NCC3=CC=CC=C3C)C=CC=C2OC.Cl

Isomeric SMILES

CCO.CCOC(=O)C1=CN=C2C(=C1NCC3=CC=CC=C3C)C=CC=C2OC.Cl

InChI

InChI=1S/C21H22N2O3.C2H6O.ClH/c1-4-26-21(24)17-13-23-20-16(10-7-11-18(20)25-3)19(17)22-12-15-9-6-5-8-14(15)2;1-2-3;/h5-11,13H,4,12H2,1-3H3,(H,22,23);3H,2H2,1H3;1H