2-methylpropyl 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: 2-methylpropyl 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: isobutyl 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6,8-dimethyl-2-phenyl-4-quinolinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-phenyl-cinchoninic acid isobutyl ester Formula: C22H23NO2 MolecularWeight: 333.42352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(C)C)C

InChI

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