(4-ethoxyphenyl) 4-(5-heptyl-4-methyl-1,3-dioxan-2-yl)benzoate

Systemtic Name: (4-ethoxyphenyl) 4-(5-heptyl-4-methyl-1,3-dioxan-2-yl)benzoate Openeye Name: (4-ethoxyphenyl) 4-(5-heptyl-4-methyl-1,3-dioxan-2-yl)benzoate CAS Name: 4-(5-heptyl-4-methyl-1,3-dioxan-2-yl)benzoic acid (4-ethoxyphenyl) ester IUPAC Name: (4-ethoxyphenyl) 4-(5-heptyl-4-methyl-1,3-dioxan-2-yl)benzoate Traditional Name: 4-(5-heptyl-4-methyl-1,3-dioxan-2-yl)benzoic acid p-phenetyl ester Formula: C27H36O5 MolecularWeight: 440.57174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1C)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCCCC1COC(OC1C)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCC

InChI

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