methyl 3-oxidanyl-2-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CSC2=C1CCCC2

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CSC2=C1CCCC2

InChI

InChI=1S/C13H17NO4S/c1-18-13(17)10(6-15)14-12(16)9-7-19-11-5-3-2-4-8(9)11/h7,10,15H,2-6H2,1H3,(H,14,16)