3-(furan-2-yl)-3-[(2-methyl-5-nitro-phenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-(furan-2-yl)-3-[(2-methyl-5-nitro-phenyl)sulfonylamino]propanoic acid Openeye Name: 3-(2-furyl)-3-[(2-methyl-5-nitro-phenyl)sulfonylamino]propanoic acid CAS Name: 3-(2-furanyl)-3-[(2-methyl-5-nitrophenyl)sulfonylamino]propanoic acid IUPAC Name: 3-(furan-2-yl)-3-[(2-methyl-5-nitrophenyl)sulfonylamino]propanoic acid Traditional Name: 3-(2-furyl)-3-[(2-methyl-5-nitro-phenyl)sulfonylamino]propionic acid Formula: C14H14N2O7S MolecularWeight: 354.33516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC(CC(=O)O)C2=CC=CO2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC(CC(=O)O)C2=CC=CO2

InChI

InChI=1S/C14H14N2O7S/c1-9-4-5-10(16(19)20)7-13(9)24(21,22)15-11(8-14(17)18)12-3-2-6-23-12/h2-7,11,15H,8H2,1H3,(H,17,18)