(4-tert-butylphenyl) 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: (4-tert-butylphenyl) 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (4-tert-butylphenyl) 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6,8-dimethyl-2-phenyl-4-quinolinecarboxylic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 6,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-phenyl-cinchoninic acid (4-tert-butylphenyl) ester Formula: C28H27NO2 MolecularWeight: 409.51948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C(C)(C)C)C

InChI

InChI=1S/C28H27NO2/c1-18-15-19(2)26-23(16-18)24(17-25(29-26)20-9-7-6-8-10-20)27(30)31-22-13-11-21(12-14-22)28(3,4)5/h6-17H,1-5H3