ethyl 3-cyano-1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrrole-2-carboxylate

Systemtic Name: ethyl 3-cyano-1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrrole-2-carboxylate Openeye Name: ethyl 3-cyano-1-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrole-2-carboxylate CAS Name: 3-cyano-1-[(2R,5S)-5-(hydroxymethyl)-2-oxolanyl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrrole-2-carboxylate Traditional Name: 3-cyano-1-[(2R,5S)-5-methyloltetrahydrofuran-2-yl]pyrrole-2-carboxylic acid ethyl ester Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CN1C2CCC(O2)CO)C#N

Isomeric SMILES

CCOC(=O)C1=C(C=CN1[C@H]2CC[C@H](O2)CO)C#N

InChI

InChI=1S/C13H16N2O4/c1-2-18-13(17)12-9(7-14)5-6-15(12)11-4-3-10(8-16)19-11/h5-6,10-11,16H,2-4,8H2,1H3/t10-,11+/m0/s1