(1-methyl-4-oxidanylidene-quinolin-3-yl) butane-1-sulfonate

Systemtic Name: (1-methyl-4-oxidanylidene-quinolin-3-yl) butane-1-sulfonate Openeye Name: (1-methyl-4-oxo-3-quinolyl) butane-1-sulfonate CAS Name: 1-butanesulfonic acid IUPAC Name: (1-methyl-4-oxoquinolin-3-yl) butane-1-sulfonate Traditional Name: butane-1-sulfonic acid (4-keto-1-methyl-3-quinolyl) ester Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)OC1=CN(C2=CC=CC=C2C1=O)C

Isomeric SMILES

CCCCS(=O)(=O)OC1=CN(C2=CC=CC=C2C1=O)C

InChI

InChI=1S/C14H17NO4S/c1-3-4-9-20(17,18)19-13-10-15(2)12-8-6-5-7-11(12)14(13)16/h5-8,10H,3-4,9H2,1-2H3