3-oxidanyl-2-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)butanoic acid

Systemtic Name: 3-oxidanyl-2-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)butanoic acid Openeye Name: 3-hydroxy-2-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)butanoic acid CAS Name: 3-hydroxy-2-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)butanoic acid Traditional Name: 3-hydroxy-2-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)butyric acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=CSC2=C1CCCC2)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C1=CSC2=C1CCCC2)O

InChI

InChI=1S/C13H17NO4S/c1-7(15)11(13(17)18)14-12(16)9-6-19-10-5-3-2-4-8(9)10/h6-7,11,15H,2-5H2,1H3,(H,14,16)(H,17,18)