2,2-dimethyl-5-[5-methyl-2-[4-methyl-4-nitroso-2,3-bis(oxidanylidene)pentoxy]phenoxy]pentanoic acid

Systemtic Name: 2,2-dimethyl-5-[5-methyl-2-[4-methyl-4-nitroso-2,3-bis(oxidanylidene)pentoxy]phenoxy]pentanoic acid Openeye Name: 2,2-dimethyl-5-[5-methyl-2-(4-methyl-4-nitroso-2,3-dioxo-pentoxy)phenoxy]pentanoic acid CAS Name: 2,2-dimethyl-5-[5-methyl-2-(4-methyl-4-nitroso-2,3-dioxopentoxy)phenoxy]pentanoic acid IUPAC Name: 2,2-dimethyl-5-[5-methyl-2-(4-methyl-4-nitroso-2,3-dioxopentoxy)phenoxy]pentanoic acid Traditional Name: 5-[2-(2,3-diketo-4-methyl-4-nitroso-pentoxy)-5-methyl-phenoxy]-2,2-dimethyl-valeric acid Formula: C20H27NO7 MolecularWeight: 393.43088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)C(=O)C(C)(C)N=O)OCCCC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)C(=O)C(C)(C)N=O)OCCCC(C)(C)C(=O)O

InChI

InChI=1S/C20H27NO7/c1-13-7-8-15(28-12-14(22)17(23)20(4,5)21-26)16(11-13)27-10-6-9-19(2,3)18(24)25/h7-8,11H,6,9-10,12H2,1-5H3,(H,24,25)