2-[4-(4-decoxyphenyl)phenyl]carbonyloxy-5-nonoxy-benzoic acid

Systemtic Name: 2-[4-(4-decoxyphenyl)phenyl]carbonyloxy-5-nonoxy-benzoic acid Openeye Name: 2-[4-(4-decoxyphenyl)benzoyl]oxy-5-nonoxy-benzoic acid CAS Name: 2-[[4-(4-decoxyphenyl)phenyl]-oxomethoxy]-5-nonoxybenzoic acid IUPAC Name: 2-[4-(4-decoxyphenyl)benzoyl]oxy-5-nonoxybenzoic acid Traditional Name: 2-[4-(4-decoxyphenyl)benzoyl]oxy-5-nonoxy-benzoic acid Formula: C39H52O6 MolecularWeight: 616.82658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)OCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)OCCCCCCCCC)C(=O)O

InChI

InChI=1S/C39H52O6/c1-3-5-7-9-11-13-15-16-28-43-34-24-22-32(23-25-34)31-18-20-33(21-19-31)39(42)45-37-27-26-35(30-36(37)38(40)41)44-29-17-14-12-10-8-6-4-2/h18-27,30H,3-17,28-29H2,1-2H3,(H,40,41)