2-[[4-(prop-2-ynylamino)phenyl]sulfonylamino]propanoic acid

Systemtic Name: 2-[[4-(prop-2-ynylamino)phenyl]sulfonylamino]propanoic acid Openeye Name: 2-[[4-(prop-2-ynylamino)phenyl]sulfonylamino]propanoic acid CAS Name: 2-[[4-(prop-2-ynylamino)phenyl]sulfonylamino]propanoic acid IUPAC Name: 2-[[4-(prop-2-ynylamino)phenyl]sulfonylamino]propanoic acid Traditional Name: 2-[[4-(propargylamino)phenyl]sulfonylamino]propionic acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O4S/c1-3-8-13-10-4-6-11(7-5-10)19(17,18)14-9(2)12(15)16/h1,4-7,9,13-14H,8H2,2H3,(H,15,16)