3-(azetidin-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name: 3-(azetidin-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 3-(azetidin-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 3-(1-azetidinyl)-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 3-(azetidin-1-yl)-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 3-(azetidin-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3

Isomeric SMILES

C1CN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3

InChI

InChI=1S/C16H16N2O5S/c17-24(21,22)14-10-11(16(19)20)9-13(18-7-4-8-18)15(14)23-12-5-2-1-3-6-12/h1-3,5-6,9-10H,4,7-8H2,(H,19,20)(H2,17,21,22)