(2R)-2-[[5-(3-methyl-3-oxidanyl-but-1-ynyl)thiophen-2-yl]carbonylamino]hexanoic acid

Systemtic Name: (2R)-2-[[5-(3-methyl-3-oxidanyl-but-1-ynyl)thiophen-2-yl]carbonylamino]hexanoic acid Openeye Name: (2R)-2-[[5-(3-hydroxy-3-methyl-but-1-ynyl)thiophene-2-carbonyl]amino]hexanoic acid CAS Name: (2R)-2-[[[5-(3-hydroxy-3-methylbut-1-ynyl)-2-thiophenyl]-oxomethyl]amino]hexanoic acid IUPAC Name: (2R)-2-[[5-(3-hydroxy-3-methylbut-1-ynyl)thiophene-2-carbonyl]amino]hexanoic acid Traditional Name: (2R)-2-[[5-(3-hydroxy-3-methyl-but-1-ynyl)thiophene-2-carbonyl]amino]hexanoic acid Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C1=CC=C(S1)C#CC(C)(C)O

Isomeric SMILES

CCCC[C@H](C(=O)O)NC(=O)C1=CC=C(S1)C#CC(C)(C)O

InChI

InChI=1S/C16H21NO4S/c1-4-5-6-12(15(19)20)17-14(18)13-8-7-11(22-13)9-10-16(2,3)21/h7-8,12,21H,4-6H2,1-3H3,(H,17,18)(H,19,20)/t12-/m1/s1