(4-tert-butylphenyl) 2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate

Systemtic Name: (4-tert-butylphenyl) 2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate Openeye Name: (4-tert-butylphenyl) 2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3,6,8-trimethyl-4-quinolinecarboxylic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 2-(3-chlorophenyl)-3,6,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3,6,8-trimethyl-cinchoninic acid (4-tert-butylphenyl) ester Formula: C29H28ClNO2 MolecularWeight: 457.99112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28ClNO2/c1-17-14-18(2)26-24(15-17)25(19(3)27(31-26)20-8-7-9-22(30)16-20)28(32)33-23-12-10-21(11-13-23)29(4,5)6/h7-16H,1-6H3