6-[2-[1,1-bis(oxidanyl)-7-phenyl-heptyl]-1,3-oxazol-5-yl]pyridine-2-carboxylic acid

Systemtic Name: 6-[2-[1,1-bis(oxidanyl)-7-phenyl-heptyl]-1,3-oxazol-5-yl]pyridine-2-carboxylic acid Openeye Name: 6-[2-(1,1-dihydroxy-7-phenyl-heptyl)oxazol-5-yl]pyridine-2-carboxylic acid CAS Name: 6-[2-(1,1-dihydroxy-7-phenylheptyl)-5-oxazolyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[2-(1,1-dihydroxy-7-phenylheptyl)-1,3-oxazol-5-yl]pyridine-2-carboxylic acid Traditional Name: 6-[2-(1,1-dihydroxy-7-phenyl-heptyl)oxazol-5-yl]picolinic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCC(C2=NC=C(O2)C3=NC(=CC=C3)C(=O)O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCC(C2=NC=C(O2)C3=NC(=CC=C3)C(=O)O)(O)O

InChI

InChI=1S/C22H24N2O5/c25-20(26)18-13-8-12-17(24-18)19-15-23-21(29-19)22(27,28)14-7-2-1-4-9-16-10-5-3-6-11-16/h3,5-6,8,10-13,15,27-28H,1-2,4,7,9,14H2,(H,25,26)