3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoic acid

Systemtic Name: 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoic acid Openeye Name: 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoic acid CAS Name: 3-[(3-hydroxyphenyl)sulfonylamino]-5-hexynoic acid IUPAC Name: 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoic acid Traditional Name: 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoic acid Formula: C12H13NO5S MolecularWeight: 283.30032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCC(CC(=O)O)NS(=O)(=O)C1=CC=CC(=C1)O

Isomeric SMILES

C#CCC(CC(=O)O)NS(=O)(=O)C1=CC=CC(=C1)O

InChI

InChI=1S/C12H13NO5S/c1-2-4-9(7-12(15)16)13-19(17,18)11-6-3-5-10(14)8-11/h1,3,5-6,8-9,13-14H,4,7H2,(H,15,16)