5-azanyl-3-(butylsulfamoyl)-3-phenoxy-cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: 5-azanyl-3-(butylsulfamoyl)-3-phenoxy-cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 5-amino-3-(butylsulfamoyl)-3-phenoxy-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 5-amino-3-(butylsulfamoyl)-3-phenoxy-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 5-amino-3-(butylsulfamoyl)-3-phenoxycyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 5-amino-3-(butylsulfamoyl)-3-phenoxy-cyclohexa-1,4-diene-1-carboxylic acid Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1(C=C(CC(=C1)N)C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

CCCCNS(=O)(=O)C1(C=C(CC(=C1)N)C(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O5S/c1-2-3-9-19-25(22,23)17(24-15-7-5-4-6-8-15)11-13(16(20)21)10-14(18)12-17/h4-8,11-12,19H,2-3,9-10,18H2,1H3,(H,20,21)