2-(4-hexoxyphenyl)-4-[4-(4-methylhexoxy)phenyl]carbonyloxy-benzoic acid

Systemtic Name: 2-(4-hexoxyphenyl)-4-[4-(4-methylhexoxy)phenyl]carbonyloxy-benzoic acid Openeye Name: 2-(4-hexoxyphenyl)-4-[4-(4-methylhexoxy)benzoyl]oxy-benzoic acid CAS Name: 2-(4-hexoxyphenyl)-4-[[4-(4-methylhexoxy)phenyl]-oxomethoxy]benzoic acid IUPAC Name: 2-(4-hexoxyphenyl)-4-[4-(4-methylhexoxy)benzoyl]oxybenzoic acid Traditional Name: 2-(4-hexoxyphenyl)-4-[4-(4-methylhexoxy)benzoyl]oxy-benzoic acid Formula: C33H40O6 MolecularWeight: 532.6671

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=C(C=CC(=C2)OC(=O)C3=CC=C(C=C3)OCCCC(C)CC)C(=O)O

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=C(C=CC(=C2)OC(=O)C3=CC=C(C=C3)OCCCC(C)CC)C(=O)O

InChI

InChI=1S/C33H40O6/c1-4-6-7-8-21-37-27-15-11-25(12-16-27)31-23-29(19-20-30(31)32(34)35)39-33(36)26-13-17-28(18-14-26)38-22-9-10-24(3)5-2/h11-20,23-24H,4-10,21-22H2,1-3H3,(H,34,35)