(2-oxidanylidene-3,4-dihydro-1H-quinolin-5-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-oxidanylidene-3,4-dihydro-1H-quinolin-5-yl) 4-methylbenzenesulfonate Openeye Name: (2-oxo-3,4-dihydro-1H-quinolin-5-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-oxo-3,4-dihydro-1H-quinolin-5-yl) ester IUPAC Name: (2-oxo-3,4-dihydro-1H-quinolin-5-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-3,4-dihydro-1H-quinolin-5-yl) ester Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2CCC(=O)N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2CCC(=O)N3

InChI

InChI=1S/C16H15NO4S/c1-11-5-7-12(8-6-11)22(19,20)21-15-4-2-3-14-13(15)9-10-16(18)17-14/h2-8H,9-10H2,1H3,(H,17,18)