3-[[4-(acetamidomethyl)phenyl]sulfonylamino]butanoic acid

Systemtic Name: 3-[[4-(acetamidomethyl)phenyl]sulfonylamino]butanoic acid Openeye Name: 3-[[4-(acetamidomethyl)phenyl]sulfonylamino]butanoic acid CAS Name: 3-[[4-(acetamidomethyl)phenyl]sulfonylamino]butanoic acid IUPAC Name: 3-[[4-(acetamidomethyl)phenyl]sulfonylamino]butanoic acid Traditional Name: 3-[[4-(acetamidomethyl)phenyl]sulfonylamino]butyric acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C

Isomeric SMILES

CC(CC(=O)O)NS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C

InChI

InChI=1S/C13H18N2O5S/c1-9(7-13(17)18)15-21(19,20)12-5-3-11(4-6-12)8-14-10(2)16/h3-6,9,15H,7-8H2,1-2H3,(H,14,16)(H,17,18)