15-[[2-(2-methyl-3-oxidanyl-3-oxidanylidene-propoxy)phenyl]amino]-15-oxidanylidene-pentadecanoic acid

Systemtic Name: 15-[[2-(2-methyl-3-oxidanyl-3-oxidanylidene-propoxy)phenyl]amino]-15-oxidanylidene-pentadecanoic acid Openeye Name: 15-[2-(3-hydroxy-2-methyl-3-oxo-propoxy)anilino]-15-oxo-pentadecanoic acid CAS Name: 15-[2-(3-hydroxy-2-methyl-3-oxopropoxy)anilino]-15-oxopentadecanoic acid IUPAC Name: 15-[2-(3-hydroxy-2-methyl-3-oxopropoxy)anilino]-15-oxopentadecanoic acid Traditional Name: 15-[2-(3-hydroxy-3-keto-2-methyl-propoxy)anilino]-15-keto-pentadecanoic acid Formula: C25H39NO6 MolecularWeight: 449.58026

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1NC(=O)CCCCCCCCCCCCCC(=O)O)C(=O)O

Isomeric SMILES

CC(COC1=CC=CC=C1NC(=O)CCCCCCCCCCCCCC(=O)O)C(=O)O

InChI

InChI=1S/C25H39NO6/c1-20(25(30)31)19-32-22-16-14-13-15-21(22)26-23(27)17-11-9-7-5-3-2-4-6-8-10-12-18-24(28)29/h13-16,20H,2-12,17-19H2,1H3,(H,26,27)(H,28,29)(H,30,31)