(1-oxidanylidene-1-propan-2-yloxy-propan-2-yl) 4-(4-octylphenyl)benzoate

Systemtic Name: (1-oxidanylidene-1-propan-2-yloxy-propan-2-yl) 4-(4-octylphenyl)benzoate Openeye Name: (2-isopropoxy-1-methyl-2-oxo-ethyl) 4-(4-octylphenyl)benzoate CAS Name: 4-(4-octylphenyl)benzoic acid (1-oxo-1-propan-2-yloxypropan-2-yl) ester IUPAC Name: (1-oxo-1-propan-2-yloxypropan-2-yl) 4-(4-octylphenyl)benzoate Traditional Name: 4-(4-octylphenyl)benzoic acid (2-isopropoxy-2-keto-1-methyl-ethyl) ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)C(=O)OC(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)C(=O)OC(C)C

InChI

InChI=1S/C27H36O4/c1-5-6-7-8-9-10-11-22-12-14-23(15-13-22)24-16-18-25(19-17-24)27(29)31-21(4)26(28)30-20(2)3/h12-21H,5-11H2,1-4H3