[4-[3-[4-(4-pentylphenyl)carbonyloxyphenyl]carbonyloxybutan-2-yloxycarbonyl]phenyl] 4-pentylbenzoate

Systemtic Name: [4-[3-[4-(4-pentylphenyl)carbonyloxyphenyl]carbonyloxybutan-2-yloxycarbonyl]phenyl] 4-pentylbenzoate Openeye Name: [4-[1-methyl-2-[4-(4-pentylbenzoyl)oxybenzoyl]oxy-propoxy]carbonylphenyl] 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid [4-[oxo-[3-[oxo-[4-[oxo-(4-pentylphenyl)methoxy]phenyl]methoxy]butan-2-yloxy]methyl]phenyl] ester IUPAC Name: [4-[3-[4-(4-pentylbenzoyl)oxybenzoyl]oxybutan-2-yloxycarbonyl]phenyl] 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid [4-[2-[4-(4-amylbenzoyl)oxybenzoyl]oxy-1-methyl-propoxy]carbonylphenyl] ester Formula: C42H46O8 MolecularWeight: 678.80984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(C)C(C)OC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)CCCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(C)C(C)OC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)CCCCC

InChI

InChI=1S/C42H46O8/c1-5-7-9-11-31-13-17-33(18-14-31)41(45)49-37-25-21-35(22-26-37)39(43)47-29(3)30(4)48-40(44)36-23-27-38(28-24-36)50-42(46)34-19-15-32(16-20-34)12-10-8-6-2/h13-30H,5-12H2,1-4H3