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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)O

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)O

InChI

InChI=1S/C13H18N2O5S/c1-10(16)14-9-11-4-6-12(7-5-11)21(19,20)15-8-2-3-13(17)18/h4-7,15H,2-3,8-9H2,1H3,(H,14,16)(H,17,18)