3-[5-[6-cyclohexyl-1-(oxidanylamino)-1-oxidanylidene-hexan-3-yl]-1,2,4-oxadiazol-3-yl]benzoic acid

Systemtic Name: 3-[5-[6-cyclohexyl-1-(oxidanylamino)-1-oxidanylidene-hexan-3-yl]-1,2,4-oxadiazol-3-yl]benzoic acid Openeye Name: 3-[5-[4-cyclohexyl-1-[2-(hydroxyamino)-2-oxo-ethyl]butyl]-1,2,4-oxadiazol-3-yl]benzoic acid CAS Name: 3-[5-[6-cyclohexyl-1-(hydroxyamino)-1-oxohexan-3-yl]-1,2,4-oxadiazol-3-yl]benzoic acid IUPAC Name: 3-[5-[6-cyclohexyl-1-(hydroxyamino)-1-oxohexan-3-yl]-1,2,4-oxadiazol-3-yl]benzoic acid Traditional Name: 3-[5-[4-cyclohexyl-1-[2-(hydroxyamino)-2-keto-ethyl]butyl]-1,2,4-oxadiazol-3-yl]benzoic acid Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCC(CC(=O)NO)C2=NC(=NO2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)CCCC(CC(=O)NO)C2=NC(=NO2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C21H27N3O5/c25-18(23-28)13-16(10-4-8-14-6-2-1-3-7-14)20-22-19(24-29-20)15-9-5-11-17(12-15)21(26)27/h5,9,11-12,14,16,28H,1-4,6-8,10,13H2,(H,23,25)(H,26,27)