4-(4-chloranylphenoxy)-3-piperidin-1-yl-5-sulfamoyl-benzoic acid

Systemtic Name: 4-(4-chloranylphenoxy)-3-piperidin-1-yl-5-sulfamoyl-benzoic acid Openeye Name: 4-(4-chlorophenoxy)-3-(1-piperidyl)-5-sulfamoyl-benzoic acid CAS Name: 4-(4-chlorophenoxy)-3-(1-piperidinyl)-5-sulfamoylbenzoic acid IUPAC Name: 4-(4-chlorophenoxy)-3-piperidin-1-yl-5-sulfamoylbenzoic acid Traditional Name: 4-(4-chlorophenoxy)-3-piperidino-5-sulfamoyl-benzoic acid Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN2O5S/c19-13-4-6-14(7-5-13)26-17-15(21-8-2-1-3-9-21)10-12(18(22)23)11-16(17)27(20,24)25/h4-7,10-11H,1-3,8-9H2,(H,22,23)(H2,20,24,25)