(3-propan-2-ylphenyl) 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonate

Systemtic Name: (3-propan-2-ylphenyl) 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonate Openeye Name: (3-isopropylphenyl) 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonate CAS Name: 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonic acid (3-propan-2-ylphenyl) ester IUPAC Name: (3-propan-2-ylphenyl) 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonate Traditional Name: 2-keto-3,4-dihydro-1H-quinoline-6-sulfonic acid m-cumenyl ester Formula: C18H19NO4S MolecularWeight: 345.41276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C18H19NO4S/c1-12(2)13-4-3-5-15(10-13)23-24(21,22)16-7-8-17-14(11-16)6-9-18(20)19-17/h3-5,7-8,10-12H,6,9H2,1-2H3,(H,19,20)