4-[4-methoxy-3-(2-methylundecan-2-yl)phenyl]carbonyloxybenzoic acid

Systemtic Name: 4-[4-methoxy-3-(2-methylundecan-2-yl)phenyl]carbonyloxybenzoic acid Openeye Name: 4-[3-(1,1-dimethyldecyl)-4-methoxy-benzoyl]oxybenzoic acid CAS Name: 4-[[4-methoxy-3-(2-methylundecan-2-yl)phenyl]-oxomethoxy]benzoic acid IUPAC Name: 4-[4-methoxy-3-(2-methylundecan-2-yl)benzoyl]oxybenzoic acid Traditional Name: 4-[3-(1,1-dimethyldecyl)-4-methoxy-benzoyl]oxybenzoic acid Formula: C27H36O5 MolecularWeight: 440.57174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)(C)C1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)O)OC

Isomeric SMILES

CCCCCCCCCC(C)(C)C1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C27H36O5/c1-5-6-7-8-9-10-11-18-27(2,3)23-19-21(14-17-24(23)31-4)26(30)32-22-15-12-20(13-16-22)25(28)29/h12-17,19H,5-11,18H2,1-4H3,(H,28,29)