(4S)-4-ethyl-2-(3-methylimidazol-4-yl)-5-oxidanylidene-oxolane-3-carboxylic acid

Systemtic Name: (4S)-4-ethyl-2-(3-methylimidazol-4-yl)-5-oxidanylidene-oxolane-3-carboxylic acid Openeye Name: (4S)-4-ethyl-2-(3-methylimidazol-4-yl)-5-oxo-tetrahydrofuran-3-carboxylic acid CAS Name: (4S)-4-ethyl-2-(3-methyl-4-imidazolyl)-5-oxo-3-oxolanecarboxylic acid IUPAC Name: (4S)-4-ethyl-2-(3-methylimidazol-4-yl)-5-oxooxolane-3-carboxylic acid Traditional Name: (4S)-4-ethyl-5-keto-2-(3-methylimidazol-4-yl)tetrahydrofuran-3-carboxylic acid Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O4/c1-3-6-8(10(14)15)9(17-11(6)16)7-4-12-5-13(7)2/h4-6,8-9H,3H2,1-2H3,(H,14,15)/t6-,8?,9?/m0/s1