(4-cyclohexylphenyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (4-cyclohexylphenyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate Openeye Name: (4-cyclohexylphenyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-4-quinolinecarboxylic acid (4-cyclohexylphenyl) ester IUPAC Name: (4-cyclohexylphenyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)cinchoninic acid (4-cyclohexylphenyl) ester Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC4=CC=C(C=C4)C5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC4=CC=C(C=C4)C5CCCCC5

InChI

InChI=1S/C29H27NO3/c1-32-23-15-13-22(14-16-23)28-19-26(25-9-5-6-10-27(25)30-28)29(31)33-24-17-11-21(12-18-24)20-7-3-2-4-8-20/h5-6,9-20H,2-4,7-8H2,1H3