2-ethyl-4-methoxy-3-[(3-methylimidazol-4-yl)methyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-ethyl-4-methoxy-3-[(3-methylimidazol-4-yl)methyl]-4-oxidanylidene-butanoic acid Openeye Name: 2-ethyl-4-methoxy-3-[(3-methylimidazol-4-yl)methyl]-4-oxo-butanoic acid CAS Name: 2-ethyl-4-methoxy-3-[(3-methyl-4-imidazolyl)methyl]-4-oxobutanoic acid IUPAC Name: 2-ethyl-4-methoxy-3-[(3-methylimidazol-4-yl)methyl]-4-oxobutanoic acid Traditional Name: 2-ethyl-4-keto-4-methoxy-3-[(3-methylimidazol-4-yl)methyl]butyric acid Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC1=CN=CN1C)C(=O)OC)C(=O)O

Isomeric SMILES

CCC(C(CC1=CN=CN1C)C(=O)OC)C(=O)O

InChI

InChI=1S/C12H18N2O4/c1-4-9(11(15)16)10(12(17)18-3)5-8-6-13-7-14(8)2/h6-7,9-10H,4-5H2,1-3H3,(H,15,16)