sodium; 2-(4-chlorophenyl)-5-methyl-4-[(2-oxidanidyl-5-sulfamoyl-phenyl)diazenyl]pyrazol-3-olate; chromium(3+)

Systemtic Name: sodium; 2-(4-chlorophenyl)-5-methyl-4-[(2-oxidanidyl-5-sulfamoyl-phenyl)diazenyl]pyrazol-3-olate; chromium(3+) Openeye Name: chromic sodium 2-(4-chlorophenyl)-5-methyl-4-(2-oxido-5-sulfamoyl-phenyl)azo-pyrazol-3-olate CAS Name: sodium; 2-(4-chlorophenyl)-5-methyl-4-(2-oxido-5-sulfamoylphenyl)azo-3-pyrazololate; chromium(3+) IUPAC Name: sodium; 2-(4-chlorophenyl)-5-methyl-4-[(2-oxido-5-sulfamoylphenyl)diazenyl]pyrazol-3-olate; chromium(3+) Traditional Name: chromic sodium 2-(4-chlorophenyl)-5-methyl-4-(2-oxido-5-sulfamoyl-phenyl)azo-pyrazol-3-olate Formula: C32H24Cl2CrN10NaO8S2 MolecularWeight: 886.61703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.[Na+].[Cr+3]

Isomeric SMILES

CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.[Na+].[Cr+3]

InChI

InChI=1S/2C16H14ClN5O4S.Cr.Na/c2*1-9-15(16(24)22(21-9)11-4-2-10(17)3-5-11)20-19-13-8-12(27(18,25)26)6-7-14(13)23;;/h2*2-8,23-24H,1H3,(H2,18,25,26);;/q;;+3;+1/p-4