methyl 3-oxidanyl-2-(4-thiophen-2-ylbutanoylamino)propanoate

Systemtic Name: methyl 3-oxidanyl-2-(4-thiophen-2-ylbutanoylamino)propanoate Openeye Name: methyl 3-hydroxy-2-[4-(2-thienyl)butanoylamino]propanoate CAS Name: 3-hydroxy-2-[(1-oxo-4-thiophen-2-ylbutyl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-(4-thiophen-2-ylbutanoylamino)propanoate Traditional Name: 3-hydroxy-2-[4-(2-thienyl)butanoylamino]propionic acid methyl ester Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CCCC1=CC=CS1

Isomeric SMILES

COC(=O)C(CO)NC(=O)CCCC1=CC=CS1

InChI

InChI=1S/C12H17NO4S/c1-17-12(16)10(8-14)13-11(15)6-2-4-9-5-3-7-18-9/h3,5,7,10,14H,2,4,6,8H2,1H3,(H,13,15)