dimethyl 2-[(3S,6R)-6-phenylmethoxy-3,6-dihydro-2H-pyran-3-yl]-2-prop-2-ynyl-propanedioate

Systemtic Name: dimethyl 2-[(3S,6R)-6-phenylmethoxy-3,6-dihydro-2H-pyran-3-yl]-2-prop-2-ynyl-propanedioate Openeye Name: dimethyl 2-[(3S,6R)-6-benzyloxy-3,6-dihydro-2H-pyran-3-yl]-2-prop-2-ynyl-propanedioate CAS Name: 2-[(3S,6R)-6-phenylmethoxy-3,6-dihydro-2H-pyran-3-yl]-2-prop-2-ynylpropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(3S,6R)-6-phenylmethoxy-3,6-dihydro-2H-pyran-3-yl]-2-prop-2-ynylpropanedioate Traditional Name: 2-[(3S,6R)-6-benzoxy-3,6-dihydro-2H-pyran-3-yl]-2-propargyl-malonic acid dimethyl ester Formula: C20H22O6 MolecularWeight: 358.38508

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC#C)(C1COC(C=C1)OCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C(CC#C)([C@H]1CO[C@@H](C=C1)OCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H22O6/c1-4-12-20(18(21)23-2,19(22)24-3)16-10-11-17(26-14-16)25-13-15-8-6-5-7-9-15/h1,5-11,16-17H,12-14H2,2-3H3/t16-,17+/m1/s1