[(2R,4R,6S)-6-(hydroxymethyl)-3,3-dimethyl-2-prop-2-enyl-oxan-4-yl] benzoate

Systemtic Name: [(2R,4R,6S)-6-(hydroxymethyl)-3,3-dimethyl-2-prop-2-enyl-oxan-4-yl] benzoate Openeye Name: [(2R,4R,6S)-2-allyl-6-(hydroxymethyl)-3,3-dimethyl-tetrahydropyran-4-yl] benzoate CAS Name: benzoic acid [(2R,4R,6S)-6-(hydroxymethyl)-3,3-dimethyl-2-prop-2-enyl-4-oxanyl] ester IUPAC Name: [(2R,4R,6S)-6-(hydroxymethyl)-3,3-dimethyl-2-prop-2-enyloxan-4-yl] benzoate Traditional Name: benzoic acid [(2R,4R,6S)-2-allyl-3,3-dimethyl-6-methylol-tetrahydropyran-4-yl] ester Formula: C18H24O4 MolecularWeight: 304.38076

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC(OC1CC=C)CO)OC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1([C@@H](C[C@H](O[C@@H]1CC=C)CO)OC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C18H24O4/c1-4-8-15-18(2,3)16(11-14(12-19)21-15)22-17(20)13-9-6-5-7-10-13/h4-7,9-10,14-16,19H,1,8,11-12H2,2-3H3/t14-,15+,16+/m0/s1