hexapotassium [2-[(5-methyl-2-oxidanidyl-phenyl)diazenyl]phenyl]methanediolate decahydroxide

Systemtic Name: hexapotassium [2-[(5-methyl-2-oxidanidyl-phenyl)diazenyl]phenyl]methanediolate decahydroxide Openeye Name: hexapotassium [2-(5-methyl-2-oxido-phenyl)azophenyl]methanediolate decahydroxide CAS Name: hexapotassium [2-(5-methyl-2-oxidophenyl)azophenyl]methanediolate decahydroxide IUPAC Name: hexapotassium [2-[(5-methyl-2-oxidophenyl)diazenyl]phenyl]methanediolate decahydroxide Traditional Name: hexapotassium [2-(5-methyl-2-oxido-phenyl)azophenyl]methanediolate decahydroxide Formula: C28H32K6N4O16-10 MolecularWeight: 915.16068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[O-])N=NC2=CC=CC=C2C([O-])[O-].CC1=CC(=C(C=C1)[O-])N=NC2=CC=CC=C2C([O-])[O-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[K+].[K+].[K+].[K+].[K+].[K+]

Isomeric SMILES

CC1=CC(=C(C=C1)[O-])N=NC2=CC=CC=C2C([O-])[O-].CC1=CC(=C(C=C1)[O-])N=NC2=CC=CC=C2C([O-])[O-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[K+].[K+].[K+].[K+].[K+].[K+]

InChI

InChI=1S/2C14H12N2O3.6K.10H2O/c2*1-9-6-7-13(17)12(8-9)16-15-11-5-3-2-4-10(11)14(18)19;;;;;;;;;;;;;;;;/h2*2-8,14,17H,1H3;;;;;;;10*1H2/q2*-2;6*+1;;;;;;;;;;/p-12