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4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate

4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name:4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate
Openeye Name:2-(benzyloxycarbonylamino)-4-methylsulfanyl-butanoate
CAS Name:4-(methylthio)-2-(phenylmethoxycarbonylamino)butanoate
IUPAC Name:4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate
Traditional Name:2-(benzyloxycarbonylamino)-4-(methylthio)butyrate
Formula: C13H16NO4S-
MolecularWeight: 282.33544
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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)OCC1=CC=CC=C1


Isomeric SMILES

CSCCC(C(=O)[O-])NC(=O)OCC1=CC=CC=C1


InChI

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


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