2-[[1-(carboxymethylsulfanyl)-3-phenyl-propan-2-yl]amino]ethanoic acid

Systemtic Name: 2-[[1-(carboxymethylsulfanyl)-3-phenyl-propan-2-yl]amino]ethanoic acid Openeye Name: 2-[[1-benzyl-2-(carboxymethylsulfanyl)ethyl]amino]acetic acid CAS Name: 2-[[1-(carboxymethylthio)-3-phenylpropan-2-yl]amino]acetic acid IUPAC Name: 2-[[1-(carboxymethylsulfanyl)-3-phenylpropan-2-yl]amino]acetic acid Traditional Name: 2-[[1-benzyl-2-(carboxymethylthio)ethyl]amino]acetic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CSCC(=O)O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CSCC(=O)O)NCC(=O)O

InChI

InChI=1S/C13H17NO4S/c15-12(16)7-14-11(8-19-9-13(17)18)6-10-4-2-1-3-5-10/h1-5,11,14H,6-9H2,(H,15,16)(H,17,18)