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

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

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C28H27NO2/c1-5-19(3)22-13-9-10-14-26(22)31-28(30)24-17-25(21-11-7-6-8-12-21)29-27-20(4)15-18(2)16-23(24)27/h6-17,19H,5H2,1-4H3