4-[6-(4-carboxyphenyl)carbonyloxy-5,6-dimethyl-heptoxy]carbonylbenzoic acid

Systemtic Name: 4-[6-(4-carboxyphenyl)carbonyloxy-5,6-dimethyl-heptoxy]carbonylbenzoic acid Openeye Name: 4-[6-(4-carboxybenzoyl)oxy-5,6-dimethyl-heptoxy]carbonylbenzoic acid CAS Name: 4-[[6-[(4-carboxyphenyl)-oxomethoxy]-5,6-dimethylheptoxy]-oxomethyl]benzoic acid IUPAC Name: 4-[6-(4-carboxybenzoyl)oxy-5,6-dimethylheptoxy]carbonylbenzoic acid Traditional Name: 4-[6-(4-carboxybenzoyl)oxy-5,6-dimethyl-heptoxy]carbonylbenzoic acid Formula: C25H28O8 MolecularWeight: 456.48502

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCOC(=O)C1=CC=C(C=C1)C(=O)O)C(C)(C)OC(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(CCCCOC(=O)C1=CC=C(C=C1)C(=O)O)C(C)(C)OC(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C25H28O8/c1-16(25(2,3)33-24(31)20-13-9-18(10-14-20)22(28)29)6-4-5-15-32-23(30)19-11-7-17(8-12-19)21(26)27/h7-14,16H,4-6,15H2,1-3H3,(H,26,27)(H,28,29)