1-(4-heptoxyphenyl)heptan-4-yl cyclohexanecarboxylate

Systemtic Name: 1-(4-heptoxyphenyl)heptan-4-yl cyclohexanecarboxylate Openeye Name: [4-(4-heptoxyphenyl)-1-propyl-butyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid 1-(4-heptoxyphenyl)heptan-4-yl ester IUPAC Name: 1-(4-heptoxyphenyl)heptan-4-yl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [4-(4-heptoxyphenyl)-1-propyl-butyl] ester Formula: C27H44O3 MolecularWeight: 416.63646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CCCC(CCC)OC(=O)C2CCCCC2

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CCCC(CCC)OC(=O)C2CCCCC2

InChI

InChI=1S/C27H44O3/c1-3-5-6-7-11-22-29-25-20-18-23(19-21-25)14-12-17-26(13-4-2)30-27(28)24-15-9-8-10-16-24/h18-21,24,26H,3-17,22H2,1-2H3