4-oxidanylidene-1-pentyl-3-[(2-sulfamoylphenyl)carbamoyl]quinolin-2-olate

Systemtic Name: 4-oxidanylidene-1-pentyl-3-[(2-sulfamoylphenyl)carbamoyl]quinolin-2-olate Openeye Name: 4-oxo-1-pentyl-3-[(2-sulfamoylphenyl)carbamoyl]quinolin-2-olate CAS Name: 4-oxo-3-[oxo-(2-sulfamoylanilino)methyl]-1-pentyl-2-quinolinolate IUPAC Name: 4-oxo-1-pentyl-3-[(2-sulfamoylphenyl)carbamoyl]quinolin-2-olate Traditional Name: 1-amyl-4-keto-3-[(2-sulfamoylphenyl)carbamoyl]quinolin-2-olate Formula: C21H22N3O5S- MolecularWeight: 428.48148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC=CC=C3S(=O)(=O)N

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC=CC=C3S(=O)(=O)N

InChI

InChI=1S/C21H23N3O5S/c1-2-3-8-13-24-16-11-6-4-9-14(16)19(25)18(21(24)27)20(26)23-15-10-5-7-12-17(15)30(22,28)29/h4-7,9-12,27H,2-3,8,13H2,1H3,(H,23,26)(H2,22,28,29)/p-1