4-octan-2-yloxycarbonyl-2-[4-[4-(2-propoxypropanoyloxy)phenyl]phenyl]benzoic acid

Systemtic Name: 4-octan-2-yloxycarbonyl-2-[4-[4-(2-propoxypropanoyloxy)phenyl]phenyl]benzoic acid Openeye Name: 4-(1-methylheptoxycarbonyl)-2-[4-[4-(2-propoxypropanoyloxy)phenyl]phenyl]benzoic acid CAS Name: 4-[octan-2-yloxy(oxo)methyl]-2-[4-[4-(1-oxo-2-propoxypropoxy)phenyl]phenyl]benzoic acid IUPAC Name: 4-octan-2-yloxycarbonyl-2-[4-[4-(2-propoxypropanoyloxy)phenyl]phenyl]benzoic acid Traditional Name: 4-(1-methylheptoxycarbonyl)-2-[4-[4-(2-propoxypropanoyloxy)phenyl]phenyl]benzoic acid Formula: C34H40O7 MolecularWeight: 560.6772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC(=C(C=C1)C(=O)O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C(C)OCCC

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC(=C(C=C1)C(=O)O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C(C)OCCC

InChI

InChI=1S/C34H40O7/c1-5-7-8-9-10-23(3)40-34(38)28-17-20-30(32(35)36)31(22-28)27-13-11-25(12-14-27)26-15-18-29(19-16-26)41-33(37)24(4)39-21-6-2/h11-20,22-24H,5-10,21H2,1-4H3,(H,35,36)