(4-octan-2-yloxycarbonylphenyl) 4-pentylbenzoate

Systemtic Name: (4-octan-2-yloxycarbonylphenyl) 4-pentylbenzoate Openeye Name: [4-(1-methylheptoxycarbonyl)phenyl] 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid [4-[octan-2-yloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-octan-2-yloxycarbonylphenyl) 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid [4-(1-methylheptoxycarbonyl)phenyl] ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C27H36O4/c1-4-6-8-10-11-21(3)30-26(28)24-17-19-25(20-18-24)31-27(29)23-15-13-22(14-16-23)12-9-7-5-2/h13-21H,4-12H2,1-3H3