1-azanyl-2-(phenylmethylsulfanyl)cyclopentane-1-carboxylic acid

Systemtic Name: 1-azanyl-2-(phenylmethylsulfanyl)cyclopentane-1-carboxylic acid Openeye Name: 1-amino-2-benzylsulfanyl-cyclopentanecarboxylic acid CAS Name: 1-amino-2-(phenylmethylthio)-1-cyclopentanecarboxylic acid IUPAC Name: 1-amino-2-benzylsulfanylcyclopentane-1-carboxylic acid Traditional Name: 1-amino-2-(benzylthio)cyclopentanecarboxylic acid Formula: C13H17NO2S MolecularWeight: 251.34458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)(C(=O)O)N)SCC2=CC=CC=C2

Isomeric SMILES

C1CC(C(C1)(C(=O)O)N)SCC2=CC=CC=C2

InChI

InChI=1S/C13H17NO2S/c14-13(12(15)16)8-4-7-11(13)17-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,14H2,(H,15,16)