[4-methyl-4-nitroso-2,3-bis(oxidanylidene)pentyl] 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate

Systemtic Name: [4-methyl-4-nitroso-2,3-bis(oxidanylidene)pentyl] 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate Openeye Name: (4-methyl-4-nitroso-2,3-dioxo-pentyl) 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate CAS Name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid (4-methyl-4-nitroso-2,3-dioxopentyl) ester IUPAC Name: (4-methyl-4-nitroso-2,3-dioxopentyl) 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoate Traditional Name: 5-(2,5-dimethylphenoxy)-2,2-dimethyl-valeric acid (2,3-diketo-4-methyl-4-nitroso-pentyl) ester Formula: C21H29NO6 MolecularWeight: 391.45806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO6/c1-14-8-9-15(2)17(12-14)27-11-7-10-20(3,4)19(25)28-13-16(23)18(24)21(5,6)22-26/h8-9,12H,7,10-11,13H2,1-6H3