2-methylpropyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: 2-methylpropyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: isobutyl 8-methyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 8-methyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 8-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=CC=C3C)C(=C2)C(=O)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)OCC(C)C

InChI

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