3-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid Openeye Name: 3-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid CAS Name: 3-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(4-but-2-ynoxyphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(4-but-2-ynoxyphenyl)sulfonylamino]propionic acid Formula: C13H15NO5S MolecularWeight: 297.3269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)O

InChI

InChI=1S/C13H15NO5S/c1-2-3-10-19-11-4-6-12(7-5-11)20(17,18)14-9-8-13(15)16/h4-7,14H,8-10H2,1H3,(H,15,16)