[(1R,2S,4R)-2-(hydroxymethyl)-4-(oxan-2-yloxy)cyclopentyl] benzoate

Systemtic Name: [(1R,2S,4R)-2-(hydroxymethyl)-4-(oxan-2-yloxy)cyclopentyl] benzoate Openeye Name: [(1R,2S,4R)-2-(hydroxymethyl)-4-tetrahydropyran-2-yloxy-cyclopentyl] benzoate CAS Name: benzoic acid [(1R,2S,4R)-2-(hydroxymethyl)-4-(2-oxanyloxy)cyclopentyl] ester IUPAC Name: [(1R,2S,4R)-2-(hydroxymethyl)-4-(oxan-2-yloxy)cyclopentyl] benzoate Traditional Name: benzoic acid [(1R,2S,4R)-2-methylol-4-tetrahydropyran-2-yloxy-cyclopentyl] ester Formula: C18H24O5 MolecularWeight: 320.38016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC2CC(C(C2)OC(=O)C3=CC=CC=C3)CO

Isomeric SMILES

C1CCOC(C1)O[C@@H]2C[C@H]([C@@H](C2)OC(=O)C3=CC=CC=C3)CO

InChI

InChI=1S/C18H24O5/c19-12-14-10-15(22-17-8-4-5-9-21-17)11-16(14)23-18(20)13-6-2-1-3-7-13/h1-3,6-7,14-17,19H,4-5,8-12H2/t14-,15+,16+,17?/m0/s1