(2-butan-2-ylphenyl) 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: (2-butan-2-ylphenyl) 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: (2-sec-butylphenyl) 3,6,8-trimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid (2-butan-2-ylphenyl) ester IUPAC Name: (2-butan-2-ylphenyl) 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 3,6,8-trimethyl-2-(p-tolyl)cinchoninic acid (2-sec-butylphenyl) ester Formula: C30H31NO2 MolecularWeight: 437.57264

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCC(C)C1=CC=CC=C1OC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C30H31NO2/c1-7-20(4)24-10-8-9-11-26(24)33-30(32)27-22(6)29(23-14-12-18(2)13-15-23)31-28-21(5)16-19(3)17-25(27)28/h8-17,20H,7H2,1-6H3