6-[(4-methoxycarbonylphenyl)methyl]-7-[(2-methylpropan-2-yl)oxy]-7-oxidanylidene-heptanoic acid

Systemtic Name: 6-[(4-methoxycarbonylphenyl)methyl]-7-[(2-methylpropan-2-yl)oxy]-7-oxidanylidene-heptanoic acid Openeye Name: 7-tert-butoxy-6-[(4-methoxycarbonylphenyl)methyl]-7-oxo-heptanoic acid CAS Name: 6-[(4-methoxycarbonylphenyl)methyl]-7-[(2-methylpropan-2-yl)oxy]-7-oxoheptanoic acid IUPAC Name: 6-[(4-methoxycarbonylphenyl)methyl]-7-[(2-methylpropan-2-yl)oxy]-7-oxoheptanoic acid Traditional Name: 7-tert-butoxy-6-(4-carbomethoxybenzyl)-7-keto-enanthic acid Formula: C20H28O6 MolecularWeight: 364.43272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCC(=O)O)CC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C(CCCCC(=O)O)CC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C20H28O6/c1-20(2,3)26-19(24)16(7-5-6-8-17(21)22)13-14-9-11-15(12-10-14)18(23)25-4/h9-12,16H,5-8,13H2,1-4H3,(H,21,22)