5-(butylamino)-4-phenoxy-3-sulfamoyl-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 5-(butylamino)-4-phenoxy-3-sulfamoyl-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 5-(butylamino)-4-phenoxy-3-sulfamoyl-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 5-(butylamino)-4-phenoxy-3-sulfamoyl-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 5-(butylamino)-4-phenoxy-3-sulfamoylcyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 5-(butylamino)-4-phenoxy-3-sulfamoyl-cyclohexa-1,5-diene-1-carboxylic acid Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC(=CC(C1OC2=CC=CC=C2)S(=O)(=O)N)C(=O)O

Isomeric SMILES

CCCCNC1=CC(=CC(C1OC2=CC=CC=C2)S(=O)(=O)N)C(=O)O

InChI

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