2-methylpropyl 6-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: 2-methylpropyl 6-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: isobutyl 6-methyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 6-methyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 6-methyl-2-(p-tolyl)cinchoninic acid isobutyl ester Formula: C22H23NO2 MolecularWeight: 333.42352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)OCC(C)C

InChI

InChI=1S/C22H23NO2/c1-14(2)13-25-22(24)19-12-21(17-8-5-15(3)6-9-17)23-20-10-7-16(4)11-18(19)20/h5-12,14H,13H2,1-4H3