2-(phenylmethoxycarbonylamino)-2-(phenylmethylsulfanyl)ethanoic acid

Systemtic Name: 2-(phenylmethoxycarbonylamino)-2-(phenylmethylsulfanyl)ethanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-2-benzylsulfanyl-acetic acid CAS Name: 2-(phenylmethoxycarbonylamino)-2-(phenylmethylthio)acetic acid IUPAC Name: 2-benzylsulfanyl-2-(phenylmethoxycarbonylamino)acetic acid Traditional Name: 2-(benzyloxycarbonylamino)-2-(benzylthio)acetic acid Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(C(=O)O)SCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(C(=O)O)SCC2=CC=CC=C2

InChI

InChI=1S/C17H17NO4S/c19-16(20)15(23-12-14-9-5-2-6-10-14)18-17(21)22-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,18,21)(H,19,20)