3-(carboxymethylsulfanyl)-2-(1-phenylethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(carboxymethylsulfanyl)-2-(1-phenylethoxycarbonylamino)propanoic acid Openeye Name: 3-(carboxymethylsulfanyl)-2-(1-phenylethoxycarbonylamino)propanoic acid CAS Name: 3-(carboxymethylthio)-2-[[oxo(1-phenylethoxy)methyl]amino]propanoic acid IUPAC Name: 3-(carboxymethylsulfanyl)-2-(1-phenylethoxycarbonylamino)propanoic acid Traditional Name: 3-(carboxymethylthio)-2-(1-phenylethoxycarbonylamino)propionic acid Formula: C14H17NO6S MolecularWeight: 327.35288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)NC(CSCC(=O)O)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)OC(=O)NC(CSCC(=O)O)C(=O)O

InChI

InChI=1S/C14H17NO6S/c1-9(10-5-3-2-4-6-10)21-14(20)15-11(13(18)19)7-22-8-12(16)17/h2-6,9,11H,7-8H2,1H3,(H,15,20)(H,16,17)(H,18,19)