[4-(2-methylbutoxycarbonyl)phenyl] 4-octoxybenzoate

Systemtic Name: [4-(2-methylbutoxycarbonyl)phenyl] 4-octoxybenzoate Openeye Name: [4-(2-methylbutoxycarbonyl)phenyl] 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid [4-[2-methylbutoxy(oxo)methyl]phenyl] ester IUPAC Name: [4-(2-methylbutoxycarbonyl)phenyl] 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid [4-(2-methylbutoxycarbonyl)phenyl] ester Formula: C27H36O5 MolecularWeight: 440.57174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC(C)CC

InChI

InChI=1S/C27H36O5/c1-4-6-7-8-9-10-19-30-24-15-11-23(12-16-24)27(29)32-25-17-13-22(14-18-25)26(28)31-20-21(3)5-2/h11-18,21H,4-10,19-20H2,1-3H3