[4-(2-methylbutan-2-yl)phenyl] 2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate

Systemtic Name: [4-(2-methylbutan-2-yl)phenyl] 2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate Openeye Name: [4-(1,1-dimethylpropyl)phenyl] 2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3,6,8-trimethyl-4-quinolinecarboxylic acid [4-(2-methylbutan-2-yl)phenyl] ester IUPAC Name: [4-(2-methylbutan-2-yl)phenyl] 2-(3-chlorophenyl)-3,6,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3,6,8-trimethyl-cinchoninic acid (4-tert-amylphenyl) ester Formula: C30H30ClNO2 MolecularWeight: 472.0177

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C30H30ClNO2/c1-7-30(5,6)22-11-13-24(14-12-22)34-29(33)26-20(4)28(21-9-8-10-23(31)17-21)32-27-19(3)15-18(2)16-25(26)27/h8-17H,7H2,1-6H3