[(1S,2R,5R)-2-acetyloxy-5-(2-oxidanylidenepyrimidin-1-yl)-3-(phenylmethoxymethyl)cyclopent-3-en-1-yl] ethanoate

Systemtic Name: [(1S,2R,5R)-2-acetyloxy-5-(2-oxidanylidenepyrimidin-1-yl)-3-(phenylmethoxymethyl)cyclopent-3-en-1-yl] ethanoate Openeye Name: [(1S,2R,5R)-2-acetoxy-3-(benzyloxymethyl)-5-(2-oxopyrimidin-1-yl)cyclopent-3-en-1-yl] acetate CAS Name: acetic acid [(1S,2R,5R)-2-acetyloxy-5-(2-oxo-1-pyrimidinyl)-3-(phenylmethoxymethyl)-1-cyclopent-3-enyl] ester IUPAC Name: [(1S,2R,5R)-2-acetyloxy-5-(2-oxopyrimidin-1-yl)-3-(phenylmethoxymethyl)cyclopent-3-en-1-yl] acetate Traditional Name: acetic acid [(1S,2R,5R)-2-acetoxy-3-(benzoxymethyl)-5-(2-ketopyrimidin-1-yl)cyclopent-3-en-1-yl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C=C(C1OC(=O)C)COCC2=CC=CC=C2)N3C=CC=NC3=O

Isomeric SMILES

CC(=O)O[C@H]1[C@@H](C=C([C@H]1OC(=O)C)COCC2=CC=CC=C2)N3C=CC=NC3=O

InChI

InChI=1S/C21H22N2O6/c1-14(24)28-19-17(13-27-12-16-7-4-3-5-8-16)11-18(20(19)29-15(2)25)23-10-6-9-22-21(23)26/h3-11,18-20H,12-13H2,1-2H3/t18-,19-,20+/m1/s1