2-[(1-methoxy-1-oxidanylidene-pentan-2-yl)-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid

Systemtic Name: 2-[(1-methoxy-1-oxidanylidene-pentan-2-yl)-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid Openeye Name: 2-[1-methoxycarbonylbutyl-(2-methyl-3-sulfanyl-propanoyl)amino]acetic acid CAS Name: 2-[(3-mercapto-2-methyl-1-oxopropyl)-(1-methoxy-1-oxopentan-2-yl)amino]acetic acid IUPAC Name: 2-[(1-methoxy-1-oxopentan-2-yl)-(2-methyl-3-sulfanylpropanoyl)amino]acetic acid Traditional Name: 2-[1-carbomethoxybutyl-(3-mercapto-2-methyl-propanoyl)amino]acetic acid Formula: C12H21NO5S MolecularWeight: 291.36384

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC)N(CC(=O)O)C(=O)C(C)CS

Isomeric SMILES

CCCC(C(=O)OC)N(CC(=O)O)C(=O)C(C)CS

InChI

InChI=1S/C12H21NO5S/c1-4-5-9(12(17)18-3)13(6-10(14)15)11(16)8(2)7-19/h8-9,19H,4-7H2,1-3H3,(H,14,15)