2-methylpentyl 4-(4-methoxyphenyl)cyclohexene-1-carboxylate

Systemtic Name: 2-methylpentyl 4-(4-methoxyphenyl)cyclohexene-1-carboxylate Openeye Name: 2-methylpentyl 4-(4-methoxyphenyl)cyclohexene-1-carboxylate CAS Name: 4-(4-methoxyphenyl)-1-cyclohexenecarboxylic acid 2-methylpentyl ester IUPAC Name: 2-methylpentyl 4-(4-methoxyphenyl)cyclohexene-1-carboxylate Traditional Name: 4-(4-methoxyphenyl)cyclohexene-1-carboxylic acid 2-methylpentyl ester Formula: C20H28O3 MolecularWeight: 316.43452

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)COC(=O)C1=CCC(CC1)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCC(C)COC(=O)C1=CCC(CC1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H28O3/c1-4-5-15(2)14-23-20(21)18-8-6-16(7-9-18)17-10-12-19(22-3)13-11-17/h8,10-13,15-16H,4-7,9,14H2,1-3H3