4-[4-(4-carboxyphenyl)carbonyloxydodecan-3-yloxycarbonyl]benzoic acid

Systemtic Name: 4-[4-(4-carboxyphenyl)carbonyloxydodecan-3-yloxycarbonyl]benzoic acid Openeye Name: 4-[2-(4-carboxybenzoyl)oxy-1-ethyl-decoxy]carbonylbenzoic acid CAS Name: 4-[4-[(4-carboxyphenyl)-oxomethoxy]dodecan-3-yloxy-oxomethyl]benzoic acid IUPAC Name: 4-[4-(4-carboxybenzoyl)oxydodecan-3-yloxycarbonyl]benzoic acid Traditional Name: 4-[2-(4-carboxybenzoyl)oxy-1-ethyl-decoxy]carbonylbenzoic acid Formula: C28H34O8 MolecularWeight: 498.56476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34O8/c1-3-5-6-7-8-9-10-24(36-28(34)22-17-13-20(14-18-22)26(31)32)23(4-2)35-27(33)21-15-11-19(12-16-21)25(29)30/h11-18,23-24H,3-10H2,1-2H3,(H,29,30)(H,31,32)