methyl 2-[2,2-dimethyl-7-(2-methyloctan-2-yl)-4,5-bis(oxidanyl)-3H-chromen-4-yl]ethanoate

Systemtic Name: methyl 2-[2,2-dimethyl-7-(2-methyloctan-2-yl)-4,5-bis(oxidanyl)-3H-chromen-4-yl]ethanoate Openeye Name: methyl 2-[7-(1,1-dimethylheptyl)-4,5-dihydroxy-2,2-dimethyl-chroman-4-yl]acetate CAS Name: 2-[4,5-dihydroxy-2,2-dimethyl-7-(2-methyloctan-2-yl)-3,4-dihydro-2H-1-benzopyran-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4,5-dihydroxy-2,2-dimethyl-7-(2-methyloctan-2-yl)-3H-chromen-4-yl]acetate Traditional Name: 2-[7-(1,1-dimethylheptyl)-4,5-dihydroxy-2,2-dimethyl-chroman-4-yl]acetic acid methyl ester Formula: C23H36O5 MolecularWeight: 392.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC2=C(C(=C1)O)C(CC(O2)(C)C)(CC(=O)OC)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC2=C(C(=C1)O)C(CC(O2)(C)C)(CC(=O)OC)O

InChI

InChI=1S/C23H36O5/c1-7-8-9-10-11-21(2,3)16-12-17(24)20-18(13-16)28-22(4,5)15-23(20,26)14-19(25)27-6/h12-13,24,26H,7-11,14-15H2,1-6H3