3-(2-azanylethyl)-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name: 3-(2-azanylethyl)-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 3-(2-aminoethyl)-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 3-(2-aminoethyl)-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 3-(2-aminoethyl)-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 3-(2-aminoethyl)-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)CCN

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)CCN

InChI

InChI=1S/C15H16N2O5S/c16-7-6-10-8-11(15(18)19)9-13(23(17,20)21)14(10)22-12-4-2-1-3-5-12/h1-5,8-9H,6-7,16H2,(H,18,19)(H2,17,20,21)