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

Systemtic Name: (4-propylphenyl) 2-methyl-4-(5-pentyl-1,3-dioxan-2-yl)cyclohexane-1-carboxylate Openeye Name: (4-propylphenyl) 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-propylphenyl) ester IUPAC Name: (4-propylphenyl) 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-propylphenyl) ester Formula: C26H40O4 MolecularWeight: 416.5934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H40O4/c1-4-6-7-9-21-17-28-26(29-18-21)22-12-15-24(19(3)16-22)25(27)30-23-13-10-20(8-5-2)11-14-23/h10-11,13-14,19,21-22,24,26H,4-9,12,15-18H2,1-3H3