(2-oxidanylidene-1H-quinolin-8-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-oxidanylidene-1H-quinolin-8-yl) 4-methylbenzenesulfonate Openeye Name: (2-oxo-1H-quinolin-8-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-oxo-1H-quinolin-8-yl) ester IUPAC Name: (2-oxo-1H-quinolin-8-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-1H-quinolin-8-yl) ester Formula: C16H13NO4S MolecularWeight: 315.34372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2NC(=O)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2NC(=O)C=C3

InChI

InChI=1S/C16H13NO4S/c1-11-5-8-13(9-6-11)22(19,20)21-14-4-2-3-12-7-10-15(18)17-16(12)14/h2-10H,1H3,(H,17,18)