(4-ethoxyphenyl) 2-methyl-4-(5-pentyl-1,3-dioxan-2-yl)cyclohexane-1-carboxylate

Systemtic Name: (4-ethoxyphenyl) 2-methyl-4-(5-pentyl-1,3-dioxan-2-yl)cyclohexane-1-carboxylate Openeye Name: (4-ethoxyphenyl) 2-methyl-4-(5-pentyl-1,3-dioxan-2-yl)cyclohexanecarboxylate CAS Name: 2-methyl-4-(5-pentyl-1,3-dioxan-2-yl)-1-cyclohexanecarboxylic acid (4-ethoxyphenyl) ester IUPAC Name: (4-ethoxyphenyl) 2-methyl-4-(5-pentyl-1,3-dioxan-2-yl)cyclohexane-1-carboxylate Traditional Name: 4-(5-amyl-1,3-dioxan-2-yl)-2-methyl-cyclohexanecarboxylic acid p-phenetyl ester Formula: C25H38O5 MolecularWeight: 418.56622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)C2CCC(C(C2)C)C(=O)OC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCC1COC(OC1)C2CCC(C(C2)C)C(=O)OC3=CC=C(C=C3)OCC

InChI

InChI=1S/C25H38O5/c1-4-6-7-8-19-16-28-25(29-17-19)20-9-14-23(18(3)15-20)24(26)30-22-12-10-21(11-13-22)27-5-2/h10-13,18-20,23,25H,4-9,14-17H2,1-3H3