4-[4-(2-imidazol-1-yl-2-oxidanylidene-ethoxy)phenyl]-3-methyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(2-imidazol-1-yl-2-oxidanylidene-ethoxy)phenyl]-3-methyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(2-imidazol-1-yl-2-oxo-ethoxy)phenyl]-3-methyl-4-oxo-butanoic acid CAS Name: 4-[4-[2-(1-imidazolyl)-2-oxoethoxy]phenyl]-3-methyl-4-oxobutanoic acid IUPAC Name: 4-[4-(2-imidazol-1-yl-2-oxoethoxy)phenyl]-3-methyl-4-oxobutanoic acid Traditional Name: 4-[4-(2-imidazol-1-yl-2-keto-ethoxy)phenyl]-4-keto-3-methyl-butyric acid Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(=O)C1=CC=C(C=C1)OCC(=O)N2C=CN=C2

Isomeric SMILES

CC(CC(=O)O)C(=O)C1=CC=C(C=C1)OCC(=O)N2C=CN=C2

InChI

InChI=1S/C16H16N2O5/c1-11(8-15(20)21)16(22)12-2-4-13(5-3-12)23-9-14(19)18-7-6-17-10-18/h2-7,10-11H,8-9H2,1H3,(H,20,21)