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

Systemtic Name: 4-(butylamino)-4-phenoxy-3-sulfamoyl-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 4-(butylamino)-4-phenoxy-3-sulfamoyl-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 4-(butylamino)-4-phenoxy-3-sulfamoyl-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 4-(butylamino)-4-phenoxy-3-sulfamoylcyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 4-(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(C=CC(=CC1S(=O)(=O)N)C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

CCCCNC1(C=CC(=CC1S(=O)(=O)N)C(=O)O)OC2=CC=CC=C2

InChI

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