2-azanyl-3-[(5-methoxycarbonylfuran-2-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(5-methoxycarbonylfuran-2-yl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(5-methoxycarbonyl-2-furyl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(5-methoxycarbonyl-2-furanyl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(5-methoxycarbonylfuran-2-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(5-carbomethoxy-2-furyl)methylthio]propionic acid Formula: C10H13NO5S MolecularWeight: 259.27892

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSCC(C(=O)O)N

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSCC(C(=O)O)N

InChI

InChI=1S/C10H13NO5S/c1-15-10(14)8-3-2-6(16-8)4-17-5-7(11)9(12)13/h2-3,7H,4-5,11H2,1H3,(H,12,13)