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

Systemtic Name: 2-methylpropyl 8-chloranyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: isobutyl 8-chloro-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 8-chloro-2-(4-methylphenyl)-4-quinolinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 8-chloro-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 8-chloro-2-(p-tolyl)cinchoninic acid isobutyl ester Formula: C21H20ClNO2 MolecularWeight: 353.842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)OCC(C)C

InChI

InChI=1S/C21H20ClNO2/c1-13(2)12-25-21(24)17-11-19(15-9-7-14(3)8-10-15)23-20-16(17)5-4-6-18(20)22/h4-11,13H,12H2,1-3H3