[(1R,2R)-2-butyl-2-(hydroxymethyl)cyclopentyl] 4-chloranylbenzoate

Systemtic Name: [(1R,2R)-2-butyl-2-(hydroxymethyl)cyclopentyl] 4-chloranylbenzoate Openeye Name: [(1R,2R)-2-butyl-2-(hydroxymethyl)cyclopentyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(1R,2R)-2-butyl-2-(hydroxymethyl)cyclopentyl] ester IUPAC Name: [(1R,2R)-2-butyl-2-(hydroxymethyl)cyclopentyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(1R,2R)-2-butyl-2-methylol-cyclopentyl] ester Formula: C17H23ClO3 MolecularWeight: 310.81572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCCC1OC(=O)C2=CC=C(C=C2)Cl)CO

Isomeric SMILES

CCCC[C@@]1(CCC[C@H]1OC(=O)C2=CC=C(C=C2)Cl)CO

InChI

InChI=1S/C17H23ClO3/c1-2-3-10-17(12-19)11-4-5-15(17)21-16(20)13-6-8-14(18)9-7-13/h6-9,15,19H,2-5,10-12H2,1H3/t15-,17-/m1/s1