4-(acetyloxymethylsulfanyl)-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 4-(acetyloxymethylsulfanyl)-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 4-(acetoxymethylsulfanyl)-2-(benzyloxycarbonylamino)butanoic acid CAS Name: 4-(acetyloxymethylthio)-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 4-(acetyloxymethylsulfanyl)-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 4-(acetoxymethylthio)-2-(benzyloxycarbonylamino)butyric acid Formula: C15H19NO6S MolecularWeight: 341.37946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCSCCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(=O)OCSCCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C15H19NO6S/c1-11(17)22-10-23-8-7-13(14(18)19)16-15(20)21-9-12-5-3-2-4-6-12/h2-6,13H,7-10H2,1H3,(H,16,20)(H,18,19)