methyl 4-[(2S,3R)-4-methylidene-5-oxidanylidene-3-(2-phenylmethoxyethyl)oxolan-2-yl]benzoate

Systemtic Name: methyl 4-[(2S,3R)-4-methylidene-5-oxidanylidene-3-(2-phenylmethoxyethyl)oxolan-2-yl]benzoate Openeye Name: methyl 4-[(2S,3R)-3-(2-benzyloxyethyl)-4-methylene-5-oxo-tetrahydrofuran-2-yl]benzoate CAS Name: 4-[(2S,3R)-4-methylene-5-oxo-3-(2-phenylmethoxyethyl)-2-oxolanyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2S,3R)-4-methylidene-5-oxo-3-(2-phenylmethoxyethyl)oxolan-2-yl]benzoate Traditional Name: 4-[(2S,3R)-3-(2-benzoxyethyl)-5-keto-4-methylene-tetrahydrofuran-2-yl]benzoic acid methyl ester Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(C(=C)C(=O)O2)CCOCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)[C@@H]2[C@@H](C(=C)C(=O)O2)CCOCC3=CC=CC=C3

InChI

InChI=1S/C22H22O5/c1-15-19(12-13-26-14-16-6-4-3-5-7-16)20(27-21(15)23)17-8-10-18(11-9-17)22(24)25-2/h3-11,19-20H,1,12-14H2,2H3/t19-,20-/m1/s1