methyl 4-[4-(1-chloranyl-5-cyclohexyl-pentyl)phenyl]butanoate

Systemtic Name: methyl 4-[4-(1-chloranyl-5-cyclohexyl-pentyl)phenyl]butanoate Openeye Name: methyl 4-[4-(1-chloro-5-cyclohexyl-pentyl)phenyl]butanoate CAS Name: 4-[4-(1-chloro-5-cyclohexylpentyl)phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(1-chloro-5-cyclohexylpentyl)phenyl]butanoate Traditional Name: 4-[4-(1-chloro-5-cyclohexyl-pentyl)phenyl]butyric acid methyl ester Formula: C22H33ClO2 MolecularWeight: 364.94922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(CCCCC2CCCCC2)Cl

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(CCCCC2CCCCC2)Cl

InChI

InChI=1S/C22H33ClO2/c1-25-22(24)13-7-11-19-14-16-20(17-15-19)21(23)12-6-5-10-18-8-3-2-4-9-18/h14-18,21H,2-13H2,1H3