(5R)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5-(4-methoxyphenyl)-3-oxidanylidene-cyclohexen-1-olate

Systemtic Name: (5R)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5-(4-methoxyphenyl)-3-oxidanylidene-cyclohexen-1-olate Openeye Name: (5R)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5-(4-methoxyphenyl)-3-oxo-cyclohexen-1-olate CAS Name: (5R)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5-(4-methoxyphenyl)-3-oxo-1-cyclohexenolate IUPAC Name: (5R)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5-(4-methoxyphenyl)-3-oxocyclohexen-1-olate Traditional Name: (5R)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-3-keto-5-(4-methoxyphenyl)cyclohexen-1-olate Formula: C19H20N3O3- MolecularWeight: 338.3804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=C(C(=O)C2)C=NCCC3=CN=CN3)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2CC(=C(C(=O)C2)C=NCCC3=CN=CN3)[O-]

InChI

InChI=1S/C19H21N3O3/c1-25-16-4-2-13(3-5-16)14-8-18(23)17(19(24)9-14)11-20-7-6-15-10-21-12-22-15/h2-5,10-12,14,23H,6-9H2,1H3,(H,21,22)/p-1/t14-/m1/s1