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

Systemtic Name: (4-ethylphenyl) 2-methyl-4-(5-pentyl-1,3-dioxan-2-yl)cyclohexane-1-carboxylate Openeye Name: (4-ethylphenyl) 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-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) 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 (4-ethylphenyl) ester Formula: C25H38O4 MolecularWeight: 402.56682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H38O4/c1-4-6-7-8-20-16-27-25(28-17-20)21-11-14-23(18(3)15-21)24(26)29-22-12-9-19(5-2)10-13-22/h9-10,12-13,18,20-21,23,25H,4-8,11,14-17H2,1-3H3