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

Systemtic Name: 2-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)-3-(phenylsulfanylmethyl)cyclopropane-1-carboxylic acid Openeye Name: 2-(1-amino-2-hydroxy-2-oxo-ethyl)-3-(phenylsulfanylmethyl)cyclopropanecarboxylic acid CAS Name: 2-(1-amino-2-hydroxy-2-oxoethyl)-3-[(phenylthio)methyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-(1-amino-2-hydroxy-2-oxoethyl)-3-(phenylsulfanylmethyl)cyclopropane-1-carboxylic acid Traditional Name: 2-(1-amino-2-hydroxy-2-keto-ethyl)-3-[(phenylthio)methyl]cyclopropanecarboxylic acid Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2C(C2C(=O)O)C(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)SCC2C(C2C(=O)O)C(C(=O)O)N

InChI

InChI=1S/C13H15NO4S/c14-11(13(17)18)9-8(10(9)12(15)16)6-19-7-4-2-1-3-5-7/h1-5,8-11H,6,14H2,(H,15,16)(H,17,18)