[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-(5-tert-butyl-2,3-dimethyl-phenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-(5-tert-butyl-2,3-dimethyl-phenyl)quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 2-(5-tert-butyl-2,3-dimethyl-phenyl)quinoline-4-carboxylate CAS Name: 2-(5-tert-butyl-2,3-dimethylphenyl)-4-quinolinecarboxylic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 2-(5-tert-butyl-2,3-dimethylphenyl)quinoline-4-carboxylate Traditional Name: 2-(5-tert-butyl-2,3-dimethyl-phenyl)cinchoninic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C31H31NO4 MolecularWeight: 481.58214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C)(C)C)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C)(C)C)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C31H31NO4/c1-19-15-22(31(3,4)5)16-25(20(19)2)28-17-26(24-9-7-8-10-27(24)32-28)30(34)36-18-29(33)21-11-13-23(35-6)14-12-21/h7-17H,18H2,1-6H3