(4-heptan-2-yloxycarbonylphenyl) 4-hexylbenzoate

Systemtic Name: (4-heptan-2-yloxycarbonylphenyl) 4-hexylbenzoate Openeye Name: [4-(1-methylhexoxycarbonyl)phenyl] 4-hexylbenzoate CAS Name: 4-hexylbenzoic acid [4-[heptan-2-yloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-heptan-2-yloxycarbonylphenyl) 4-hexylbenzoate Traditional Name: 4-hexylbenzoic acid [4-(1-methylhexoxycarbonyl)phenyl] ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(C)CCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(C)CCCCC

InChI

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