[(3S)-2-oxidanylideneoxolan-3-yl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propenoic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1,3,5-trimethylpyrazol-4-yl)acrylic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)OC2CCOC2=O

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)O[C@H]2CCOC2=O

InChI

InChI=1S/C13H16N2O4/c1-8-10(9(2)15(3)14-8)4-5-12(16)19-11-6-7-18-13(11)17/h4-5,11H,6-7H2,1-3H3/b5-4+/t11-/m0/s1