potassium (E)-[2-butyl-5-chloranyl-3-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-2H-imidazol-4-ylidene]methanolate

Systemtic Name: potassium (E)-[2-butyl-5-chloranyl-3-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-2H-imidazol-4-ylidene]methanolate Openeye Name: potassium (E)-[2-butyl-5-chloro-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-2H-imidazol-4-ylidene]methanolate CAS Name: potassium (E)-[2-butyl-5-chloro-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-2H-imidazol-4-ylidene]methanolate IUPAC Name: potassium (E)-[2-butyl-5-chloro-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-2H-imidazol-4-ylidene]methanolate Traditional Name: potassium (E)-[2-butyl-5-chloro-3-[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]-3-imidazolin-4-ylidene]methanolate Formula: C22H22ClKN6O MolecularWeight: 461.00098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N=C(C(=C[O-])N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)Cl.[K+]

Isomeric SMILES

CCCCC1N=C(/C(=C\[O-])/N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)Cl.[K+]

InChI

InChI=1S/C22H23ClN6O.K/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22;/h4-7,9-12,14,20,30H,2-3,8,13H2,1H3,(H,25,26,27,28);/q;+1/p-1/b19-14+;