2-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)-3-(2-sulfanylethyl)cyclopropane-1-carboxylic acid

Systemtic Name: 2-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)-3-(2-sulfanylethyl)cyclopropane-1-carboxylic acid Openeye Name: 2-(1-amino-2-hydroxy-2-oxo-ethyl)-3-(2-sulfanylethyl)cyclopropanecarboxylic acid CAS Name: 2-(1-amino-2-hydroxy-2-oxoethyl)-3-(2-mercaptoethyl)-1-cyclopropanecarboxylic acid IUPAC Name: 2-(1-amino-2-hydroxy-2-oxoethyl)-3-(2-sulfanylethyl)cyclopropane-1-carboxylic acid Traditional Name: 2-(1-amino-2-hydroxy-2-keto-ethyl)-3-(2-mercaptoethyl)cyclopropanecarboxylic acid Formula: C8H13NO4S MolecularWeight: 219.25812

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Descriptors Computed from Structure

Canonical SMILES:

C(CS)C1C(C1C(=O)O)C(C(=O)O)N

Isomeric SMILES

C(CS)C1C(C1C(=O)O)C(C(=O)O)N

InChI

InChI=1S/C8H13NO4S/c9-6(8(12)13)4-3(1-2-14)5(4)7(10)11/h3-6,14H,1-2,9H2,(H,10,11)(H,12,13)