3-(furan-2-yl)-3-[(4-nitrophenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-(furan-2-yl)-3-[(4-nitrophenyl)sulfonylamino]propanoic acid Openeye Name: 3-(2-furyl)-3-[(4-nitrophenyl)sulfonylamino]propanoic acid CAS Name: 3-(2-furanyl)-3-[(4-nitrophenyl)sulfonylamino]propanoic acid IUPAC Name: 3-(furan-2-yl)-3-[(4-nitrophenyl)sulfonylamino]propanoic acid Traditional Name: 3-(2-furyl)-3-(nosylamino)propionic acid Formula: C13H12N2O7S MolecularWeight: 340.30858

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O7S/c16-13(17)8-11(12-2-1-7-22-12)14-23(20,21)10-5-3-9(4-6-10)15(18)19/h1-7,11,14H,8H2,(H,16,17)