2-azanyl-2-phenylmethoxycarbonyl-4-sulfanyl-butanoic acid

Systemtic Name: 2-azanyl-2-phenylmethoxycarbonyl-4-sulfanyl-butanoic acid Openeye Name: 2-amino-2-benzyloxycarbonyl-4-sulfanyl-butanoic acid CAS Name: 2-amino-4-mercapto-2-phenylmethoxycarbonylbutanoic acid IUPAC Name: 2-amino-2-phenylmethoxycarbonyl-4-sulfanylbutanoic acid Traditional Name: 2-amino-2-carbobenzoxy-4-mercapto-butyric acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CCS)(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CCS)(C(=O)O)N

InChI

InChI=1S/C12H15NO4S/c13-12(6-7-18,10(14)15)11(16)17-8-9-4-2-1-3-5-9/h1-5,18H,6-8,13H2,(H,14,15)