(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 3-acetamido-4-methoxy-benzenesulfonate

Systemtic Name: (2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 3-acetamido-4-methoxy-benzenesulfonate Openeye Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 3-acetamido-4-methoxy-benzenesulfonate CAS Name: 3-acetamido-4-methoxybenzenesulfonic acid (2-oxo-3,4-dihydro-1H-quinolin-6-yl) ester IUPAC Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 3-acetamido-4-methoxybenzenesulfonate Traditional Name: 3-acetamido-4-methoxy-benzenesulfonic acid (2-keto-3,4-dihydro-1H-quinolin-6-yl) ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3)OC

InChI

InChI=1S/C18H18N2O6S/c1-11(21)19-16-10-14(5-7-17(16)25-2)27(23,24)26-13-4-6-15-12(9-13)3-8-18(22)20-15/h4-7,9-10H,3,8H2,1-2H3,(H,19,21)(H,20,22)