(5E)-5-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-4-oxidanylidene-1H-imidazol-2-olate

Systemtic Name: (5E)-5-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-4-oxidanylidene-1H-imidazol-2-olate Openeye Name: (5E)-5-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-4-oxo-1H-imidazol-2-olate CAS Name: (5E)-5-[[1-(4-butylphenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-4-oxo-1H-imidazol-2-olate IUPAC Name: (5E)-5-[[1-(4-butylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-4-oxo-1H-imidazol-2-olate Traditional Name: (4E)-4-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-5-keto-2-imidazolin-2-olate Formula: C20H22N3O2- MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)N=C(N3)[O-])C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=CC(=C2C)/C=C/3\C(=O)N=C(N3)[O-])C

InChI

InChI=1S/C20H23N3O2/c1-4-5-6-15-7-9-17(10-8-15)23-13(2)11-16(14(23)3)12-18-19(24)22-20(25)21-18/h7-12H,4-6H2,1-3H3,(H2,21,22,24,25)/p-1/b18-12+