(4-tert-butylphenyl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: (4-tert-butylphenyl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (4-tert-butylphenyl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-2-phenyl-4-quinolinecarboxylic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-2-phenyl-cinchoninic acid (4-tert-butylbenzyl) ester Formula: C28H27NO2 MolecularWeight: 409.51948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C28H27NO2/c1-19-25(27(30)31-18-20-14-16-22(17-15-20)28(2,3)4)23-12-8-9-13-24(23)29-26(19)21-10-6-5-7-11-21/h5-17H,18H2,1-4H3