3-(6-methylpyridin-2-yl)propyl 2-(4-methoxyphenyl)quinoline-4-carboxylate hydrochloride

Systemtic Name: 3-(6-methylpyridin-2-yl)propyl 2-(4-methoxyphenyl)quinoline-4-carboxylate hydrochloride Openeye Name: 3-(6-methyl-2-pyridyl)propyl 2-(4-methoxyphenyl)quinoline-4-carboxylate hydrochloride CAS Name: 2-(4-methoxyphenyl)-4-quinolinecarboxylic acid 3-(6-methyl-2-pyridinyl)propyl ester hydrochloride IUPAC Name: 3-(6-methylpyridin-2-yl)propyl 2-(4-methoxyphenyl)quinoline-4-carboxylate hydrochloride Traditional Name: 2-(4-methoxyphenyl)cinchoninic acid 3-(6-methyl-2-pyridyl)propyl ester hydrochloride Formula: C26H25ClN2O3 MolecularWeight: 448.9413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CCCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC.Cl

Isomeric SMILES

CC1=NC(=CC=C1)CCCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC.Cl

InChI

InChI=1S/C26H24N2O3.ClH/c1-18-7-5-8-20(27-18)9-6-16-31-26(29)23-17-25(19-12-14-21(30-2)15-13-19)28-24-11-4-3-10-22(23)24;/h3-5,7-8,10-15,17H,6,9,16H2,1-2H3;1H