4-[4-[12-(4-oxidanyl-4-oxidanylidene-butanoyl)oxydodecoxy]phenyl]benzoic acid

Systemtic Name: 4-[4-[12-(4-oxidanyl-4-oxidanylidene-butanoyl)oxydodecoxy]phenyl]benzoic acid Openeye Name: 4-[4-[12-(4-hydroxy-4-oxo-butanoyl)oxydodecoxy]phenyl]benzoic acid CAS Name: 4-[4-[12-(4-hydroxy-1,4-dioxobutoxy)dodecoxy]phenyl]benzoic acid IUPAC Name: 4-[4-[12-(4-hydroxy-4-oxobutanoyl)oxydodecoxy]phenyl]benzoic acid Traditional Name: 4-[4-[12-(4-hydroxy-4-keto-butanoyl)oxydodecoxy]phenyl]benzoic acid Formula: C29H38O7 MolecularWeight: 498.60782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)OCCCCCCCCCCCCOC(=O)CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)OCCCCCCCCCCCCOC(=O)CCC(=O)O)C(=O)O

InChI

InChI=1S/C29H38O7/c30-27(31)19-20-28(32)36-22-10-8-6-4-2-1-3-5-7-9-21-35-26-17-15-24(16-18-26)23-11-13-25(14-12-23)29(33)34/h11-18H,1-10,19-22H2,(H,30,31)(H,33,34)