2-(3-acetamido-4-methoxycarbonyl-2,5-dihydrothiophen-2-yl)pentanoic acid

Systemtic Name: 2-(3-acetamido-4-methoxycarbonyl-2,5-dihydrothiophen-2-yl)pentanoic acid Openeye Name: 2-(3-acetamido-4-methoxycarbonyl-2,5-dihydrothiophen-2-yl)pentanoic acid CAS Name: 2-(3-acetamido-4-methoxycarbonyl-2,5-dihydrothiophen-2-yl)pentanoic acid IUPAC Name: 2-(3-acetamido-4-methoxycarbonyl-2,5-dihydrothiophen-2-yl)pentanoic acid Traditional Name: 2-(3-acetamido-4-carbomethoxy-2,5-dihydrothiophen-2-yl)valeric acid Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1C(=C(CS1)C(=O)OC)NC(=O)C)C(=O)O

Isomeric SMILES

CCCC(C1C(=C(CS1)C(=O)OC)NC(=O)C)C(=O)O

InChI

InChI=1S/C13H19NO5S/c1-4-5-8(12(16)17)11-10(14-7(2)15)9(6-20-11)13(18)19-3/h8,11H,4-6H2,1-3H3,(H,14,15)(H,16,17)