(5S)-5-(2-chlorophenyl)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-3-oxidanylidene-cyclohexen-1-olate

Systemtic Name: (5S)-5-(2-chlorophenyl)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-3-oxidanylidene-cyclohexen-1-olate Openeye Name: (5S)-5-(2-chlorophenyl)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-3-oxo-cyclohexen-1-olate CAS Name: (5S)-5-(2-chlorophenyl)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-3-oxo-1-cyclohexenolate IUPAC Name: (5S)-5-(2-chlorophenyl)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-3-oxocyclohexen-1-olate Traditional Name: (5S)-5-(2-chlorophenyl)-2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-3-keto-cyclohexen-1-olate Formula: C18H17ClN3O2- MolecularWeight: 342.79948

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C(=C1[O-])C=NCCC2=CN=CN2)C3=CC=CC=C3Cl

Isomeric SMILES

C1[C@@H](CC(=O)C(=C1[O-])C=NCCC2=CN=CN2)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H18ClN3O2/c19-16-4-2-1-3-14(16)12-7-17(23)15(18(24)8-12)10-20-6-5-13-9-21-11-22-13/h1-4,9-12,23H,5-8H2,(H,21,22)/p-1/t12-/m0/s1