azanyl 2-[(1-butyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]benzenesulfinate

Systemtic Name: azanyl 2-[(1-butyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]benzenesulfinate Openeye Name: amino 2-[(1-butyl-2-hydroxy-4-oxo-quinoline-3-carbonyl)amino]benzenesulfinate CAS Name: 2-[[(1-butyl-2-hydroxy-4-oxo-3-quinolinyl)-oxomethyl]amino]benzenesulfinic acid amino ester IUPAC Name: amino 2-[(1-butyl-2-hydroxy-4-oxoquinoline-3-carbonyl)amino]benzenesulfinate Traditional Name: 2-[(1-butyl-2-hydroxy-4-keto-quinoline-3-carbonyl)amino]benzenesulfinic acid amino ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=CC=C3S(=O)ON

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=CC=C3S(=O)ON

InChI

InChI=1S/C20H21N3O5S/c1-2-3-12-23-15-10-6-4-8-13(15)18(24)17(20(23)26)19(25)22-14-9-5-7-11-16(14)29(27)28-21/h4-11,26H,2-3,12,21H2,1H3,(H,22,25)