2-methyl-3-(phenylmethoxycarbonylaminomethylsulfanyl)propanoic acid

Systemtic Name: 2-methyl-3-(phenylmethoxycarbonylaminomethylsulfanyl)propanoic acid Openeye Name: 3-(benzyloxycarbonylaminomethylsulfanyl)-2-methyl-propanoic acid CAS Name: 2-methyl-3-(phenylmethoxycarbonylaminomethylthio)propanoic acid IUPAC Name: 2-methyl-3-(phenylmethoxycarbonylaminomethylsulfanyl)propanoic acid Traditional Name: 3-(benzyloxycarbonylaminomethylthio)-2-methyl-propionic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCNC(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(CSCNC(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H17NO4S/c1-10(12(15)16)8-19-9-14-13(17)18-7-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,14,17)(H,15,16)