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

Systemtic Name: methyl 2-(4-tert-butylphenyl)quinoline-4-carboxylate Openeye Name: methyl 2-(4-tert-butylphenyl)quinoline-4-carboxylate CAS Name: 2-(4-tert-butylphenyl)-4-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-tert-butylphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-tert-butylphenyl)cinchoninic acid methyl ester Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC

InChI

InChI=1S/C21H21NO2/c1-21(2,3)15-11-9-14(10-12-15)19-13-17(20(23)24-4)16-7-5-6-8-18(16)22-19/h5-13H,1-4H3