[(E)-3-methyl-6-[(2R,5R)-2-methyl-5-(2-oxidanylpropan-2-yl)oxolan-2-yl]-6-oxidanylidene-hex-2-enyl] benzoate

Systemtic Name: [(E)-3-methyl-6-[(2R,5R)-2-methyl-5-(2-oxidanylpropan-2-yl)oxolan-2-yl]-6-oxidanylidene-hex-2-enyl] benzoate Openeye Name: [(E)-6-[(2R,5R)-5-(1-hydroxy-1-methyl-ethyl)-2-methyl-tetrahydrofuran-2-yl]-3-methyl-6-oxo-hex-2-enyl] benzoate CAS Name: benzoic acid [(E)-6-[(2R,5R)-5-(2-hydroxypropan-2-yl)-2-methyl-2-oxolanyl]-3-methyl-6-oxohex-2-enyl] ester IUPAC Name: [(E)-6-[(2R,5R)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-3-methyl-6-oxohex-2-enyl] benzoate Traditional Name: benzoic acid [(E)-6-[(2R,5R)-5-(1-hydroxy-1-methyl-ethyl)-2-methyl-tetrahydrofuran-2-yl]-6-keto-3-methyl-hex-2-enyl] ester Formula: C22H30O5 MolecularWeight: 374.4706

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C1=CC=CC=C1)CCC(=O)C2(CCC(O2)C(C)(C)O)C

Isomeric SMILES

C/C(=C\COC(=O)C1=CC=CC=C1)/CCC(=O)[C@]2(CC[C@@H](O2)C(C)(C)O)C

InChI

InChI=1S/C22H30O5/c1-16(13-15-26-20(24)17-8-6-5-7-9-17)10-11-18(23)22(4)14-12-19(27-22)21(2,3)25/h5-9,13,19,25H,10-12,14-15H2,1-4H3/b16-13+/t19-,22-/m1/s1