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

Systemtic Name: 3-(2-azanylethyl)-4-chloranyl-5-sulfamoyl-benzoic acid Openeye Name: 3-(2-aminoethyl)-4-chloro-5-sulfamoyl-benzoic acid CAS Name: 3-(2-aminoethyl)-4-chloro-5-sulfamoylbenzoic acid IUPAC Name: 3-(2-aminoethyl)-4-chloro-5-sulfamoylbenzoic acid Traditional Name: 3-(2-aminoethyl)-4-chloro-5-sulfamoyl-benzoic acid Formula: C9H11ClN2O4S MolecularWeight: 278.71264

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1CCN)Cl)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1CCN)Cl)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C9H11ClN2O4S/c10-8-5(1-2-11)3-6(9(13)14)4-7(8)17(12,15)16/h3-4H,1-2,11H2,(H,13,14)(H2,12,15,16)