(2R)-2-[[7-[4-(hydroxymethyl)-1,2,3-triazol-1-yl]dibenzofuran-3-yl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: (2R)-2-[[7-[4-(hydroxymethyl)-1,2,3-triazol-1-yl]dibenzofuran-3-yl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: (2R)-2-[[7-[4-(hydroxymethyl)triazol-1-yl]dibenzofuran-3-yl]sulfonylamino]-3-methyl-butanoic acid CAS Name: (2R)-2-[[7-[4-(hydroxymethyl)-1-triazolyl]-3-dibenzofuranyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: (2R)-2-[[7-[4-(hydroxymethyl)triazol-1-yl]dibenzofuran-3-yl]sulfonylamino]-3-methylbutanoic acid Traditional Name: (2R)-3-methyl-2-[[7-(4-methyloltriazol-1-yl)dibenzofuran-3-yl]sulfonylamino]butyric acid Formula: C20H20N4O6S MolecularWeight: 444.461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)C3=C(O2)C=C(C=C3)N4C=C(N=N4)CO

Isomeric SMILES

CC(C)[C@H](C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)C3=C(O2)C=C(C=C3)N4C=C(N=N4)CO

InChI

InChI=1S/C20H20N4O6S/c1-11(2)19(20(26)27)22-31(28,29)14-4-6-16-15-5-3-13(7-17(15)30-18(16)8-14)24-9-12(10-25)21-23-24/h3-9,11,19,22,25H,10H2,1-2H3,(H,26,27)/t19-/m1/s1