[(3R,5S)-2-(cyanomethyl)-5-[(2S)-pent-4-en-2-yl]oxolan-3-yl] 2-methoxy-6-prop-2-enyl-benzoate

Systemtic Name: [(3R,5S)-2-(cyanomethyl)-5-[(2S)-pent-4-en-2-yl]oxolan-3-yl] 2-methoxy-6-prop-2-enyl-benzoate Openeye Name: [(3R,5S)-2-(cyanomethyl)-5-[(1S)-1-methylbut-3-enyl]tetrahydrofuran-3-yl] 2-allyl-6-methoxy-benzoate CAS Name: 2-methoxy-6-prop-2-enylbenzoic acid [(3R,5S)-2-(cyanomethyl)-5-[(2S)-pent-4-en-2-yl]-3-oxolanyl] ester IUPAC Name: [(3R,5S)-2-(cyanomethyl)-5-[(2S)-pent-4-en-2-yl]oxolan-3-yl] 2-methoxy-6-prop-2-enylbenzoate Traditional Name: 2-allyl-6-methoxy-benzoic acid [(3R,5S)-2-(cyanomethyl)-5-[(1S)-1-methylbut-3-enyl]tetrahydrofuran-3-yl] ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=C)C1CC(C(O1)CC#N)OC(=O)C2=C(C=CC=C2OC)CC=C

Isomeric SMILES

C[C@@H](CC=C)[C@@H]1C[C@H](C(O1)CC#N)OC(=O)C2=C(C=CC=C2OC)CC=C

InChI

InChI=1S/C22H27NO4/c1-5-8-15(3)19-14-20(17(26-19)12-13-23)27-22(24)21-16(9-6-2)10-7-11-18(21)25-4/h5-7,10-11,15,17,19-20H,1-2,8-9,12,14H2,3-4H3/t15-,17?,19-,20+/m0/s1