2-methoxy-5-[(4-methyl-2-oxidanylidene-1H-quinolin-6-yl)methyl]benzenesulfonic acid

Systemtic Name: 2-methoxy-5-[(4-methyl-2-oxidanylidene-1H-quinolin-6-yl)methyl]benzenesulfonic acid Openeye Name: 2-methoxy-5-[(4-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzenesulfonic acid CAS Name: 2-methoxy-5-[(4-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzenesulfonic acid IUPAC Name: 2-methoxy-5-[(4-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzenesulfonic acid Traditional Name: 5-[(2-keto-4-methyl-1H-quinolin-6-yl)methyl]-2-methoxy-besylic acid Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC2=C1C=C(C=C2)CC3=CC(=C(C=C3)OC)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=O)NC2=C1C=C(C=C2)CC3=CC(=C(C=C3)OC)S(=O)(=O)O

InChI

InChI=1S/C18H17NO5S/c1-11-7-18(20)19-15-5-3-12(9-14(11)15)8-13-4-6-16(24-2)17(10-13)25(21,22)23/h3-7,9-10H,8H2,1-2H3,(H,19,20)(H,21,22,23)