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

Systemtic Name: 2-azanyl-3-[(3-ethoxycarbonylfuran-2-yl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(3-ethoxycarbonyl-2-furyl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(3-ethoxycarbonyl-2-furanyl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(3-ethoxycarbonylfuran-2-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(3-carbethoxy-2-furyl)methylthio]propionic acid Formula: C11H15NO5S MolecularWeight: 273.3055

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CSCC(C(=O)O)N

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CSCC(C(=O)O)N

InChI

InChI=1S/C11H15NO5S/c1-2-16-11(15)7-3-4-17-9(7)6-18-5-8(12)10(13)14/h3-4,8H,2,5-6,12H2,1H3,(H,13,14)