(5-methylquinolin-8-yl) 4-tert-butylbenzoate

Systemtic Name: (5-methylquinolin-8-yl) 4-tert-butylbenzoate Openeye Name: (5-methyl-8-quinolyl) 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid (5-methyl-8-quinolinyl) ester IUPAC Name: (5-methylquinolin-8-yl) 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid (5-methyl-8-quinolyl) ester Formula: C21H21NO2 MolecularWeight: 319.39694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=NC2=C(C=C1)OC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C2C=CC=NC2=C(C=C1)OC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

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