(2-methylquinolin-8-yl) 4-ethoxybenzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 4-ethoxybenzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C18H17NO4S MolecularWeight: 343.39688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2N=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2N=C(C=C3)C

InChI

InChI=1S/C18H17NO4S/c1-3-22-15-9-11-16(12-10-15)24(20,21)23-17-6-4-5-14-8-7-13(2)19-18(14)17/h4-12H,3H2,1-2H3