methyl (3S,4S)-4-ethyl-2-(3-methylimidazol-4-yl)-5-oxidanylidene-oxolane-3-carboxylate

Systemtic Name: methyl (3S,4S)-4-ethyl-2-(3-methylimidazol-4-yl)-5-oxidanylidene-oxolane-3-carboxylate Openeye Name: methyl (3S,4S)-4-ethyl-2-(3-methylimidazol-4-yl)-5-oxo-tetrahydrofuran-3-carboxylate CAS Name: (3S,4S)-4-ethyl-2-(3-methyl-4-imidazolyl)-5-oxo-3-oxolanecarboxylic acid methyl ester IUPAC Name: methyl (3S,4S)-4-ethyl-2-(3-methylimidazol-4-yl)-5-oxooxolane-3-carboxylate Traditional Name: (3S,4S)-4-ethyl-5-keto-2-(3-methylimidazol-4-yl)tetrahydrofuran-3-carboxylic acid methyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(OC1=O)C2=CN=CN2C)C(=O)OC

Isomeric SMILES

CC[C@H]1[C@@H](C(OC1=O)C2=CN=CN2C)C(=O)OC

InChI

InChI=1S/C12H16N2O4/c1-4-7-9(12(16)17-3)10(18-11(7)15)8-5-13-6-14(8)2/h5-7,9-10H,4H2,1-3H3/t7-,9-,10?/m0/s1