(2-butan-2-ylphenyl) 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: (2-butan-2-ylphenyl) 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: (2-sec-butylphenyl) 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-6,8-dimethyl-4-quinolinecarboxylic acid (2-butan-2-ylphenyl) ester IUPAC Name: (2-butan-2-ylphenyl) 2-(4-methoxyphenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-6,8-dimethyl-cinchoninic acid (2-sec-butylphenyl) ester Formula: C29H29NO3 MolecularWeight: 439.54546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29NO3/c1-6-19(3)23-9-7-8-10-27(23)33-29(31)25-17-26(21-11-13-22(32-5)14-12-21)30-28-20(4)15-18(2)16-24(25)28/h7-17,19H,6H2,1-5H3