ethyl 2-[1-(1H-imidazol-5-yl)ethyl]-3-oxidanylidene-4-phenylmethoxy-butanoate

Systemtic Name: ethyl 2-[1-(1H-imidazol-5-yl)ethyl]-3-oxidanylidene-4-phenylmethoxy-butanoate Openeye Name: ethyl 4-benzyloxy-2-[1-(1H-imidazol-5-yl)ethyl]-3-oxo-butanoate CAS Name: 2-[1-(1H-imidazol-5-yl)ethyl]-3-oxo-4-phenylmethoxybutanoic acid ethyl ester IUPAC Name: ethyl 2-[1-(1H-imidazol-5-yl)ethyl]-3-oxo-4-phenylmethoxybutanoate Traditional Name: 4-benzoxy-2-[1-(1H-imidazol-5-yl)ethyl]-3-keto-butyric acid ethyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C1=CN=CN1)C(=O)COCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C(C)C1=CN=CN1)C(=O)COCC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O4/c1-3-24-18(22)17(13(2)15-9-19-12-20-15)16(21)11-23-10-14-7-5-4-6-8-14/h4-9,12-13,17H,3,10-11H2,1-2H3,(H,19,20)