3-(3-azanyl-1-benzofuran-2-yl)-2-sulfonyl-propanoic acid

Systemtic Name: 3-(3-azanyl-1-benzofuran-2-yl)-2-sulfonyl-propanoic acid Openeye Name: 3-(3-aminobenzofuran-2-yl)-2-sulfonyl-propanoic acid CAS Name: 3-(3-amino-2-benzofuranyl)-2-sulfonylpropanoic acid IUPAC Name: 3-(3-amino-1-benzofuran-2-yl)-2-sulfonylpropanoic acid Traditional Name: 3-(3-aminobenzofuran-2-yl)-2-sulfonyl-propionic acid Formula: C11H9NO5S MolecularWeight: 267.25786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)CC(=S(=O)=O)C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)CC(=S(=O)=O)C(=O)O)N

InChI

InChI=1S/C11H9NO5S/c12-10-6-3-1-2-4-7(6)17-8(10)5-9(11(13)14)18(15)16/h1-4H,5,12H2,(H,13,14)