13-[[4-methyl-3-(4-oxidanyl-4-oxidanylidene-butoxy)pyridin-2-yl]amino]-13-oxidanylidene-tridecanoic acid

Systemtic Name: 13-[[4-methyl-3-(4-oxidanyl-4-oxidanylidene-butoxy)pyridin-2-yl]amino]-13-oxidanylidene-tridecanoic acid Openeye Name: 13-[[3-(4-hydroxy-4-oxo-butoxy)-4-methyl-2-pyridyl]amino]-13-oxo-tridecanoic acid CAS Name: 13-[[3-(4-hydroxy-4-oxobutoxy)-4-methyl-2-pyridinyl]amino]-13-oxotridecanoic acid IUPAC Name: 13-[[3-(4-hydroxy-4-oxobutoxy)-4-methylpyridin-2-yl]amino]-13-oxotridecanoic acid Traditional Name: 13-[[3-(4-hydroxy-4-keto-butoxy)-4-methyl-2-pyridyl]amino]-13-keto-tridecanoic acid Formula: C23H36N2O6 MolecularWeight: 436.54174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)NC(=O)CCCCCCCCCCCC(=O)O)OCCCC(=O)O

Isomeric SMILES

CC1=C(C(=NC=C1)NC(=O)CCCCCCCCCCCC(=O)O)OCCCC(=O)O

InChI

InChI=1S/C23H36N2O6/c1-18-15-16-24-23(22(18)31-17-11-14-21(29)30)25-19(26)12-9-7-5-3-2-4-6-8-10-13-20(27)28/h15-16H,2-14,17H2,1H3,(H,27,28)(H,29,30)(H,24,25,26)