methyl 2-(1-benzothiophen-2-ylcarbonylamino)-3-oxidanyl-propanoate

Systemtic Name: methyl 2-(1-benzothiophen-2-ylcarbonylamino)-3-oxidanyl-propanoate Openeye Name: methyl 2-(benzothiophene-2-carbonylamino)-3-hydroxy-propanoate CAS Name: 2-[[1-benzothiophen-2-yl(oxo)methyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-(1-benzothiophene-2-carbonylamino)-3-hydroxypropanoate Traditional Name: 2-(benzothiophene-2-carbonylamino)-3-hydroxy-propionic acid methyl ester Formula: C13H13NO4S MolecularWeight: 279.31162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC2=CC=CC=C2S1

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC2=CC=CC=C2S1

InChI

InChI=1S/C13H13NO4S/c1-18-13(17)9(7-15)14-12(16)11-6-8-4-2-3-5-10(8)19-11/h2-6,9,15H,7H2,1H3,(H,14,16)