sodium; 5-[bis(oxidanidyl)amino]-3-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinylidene]-4-oxidanylidene-cyclohexa-1,5-diene-1-sulfonate; chromium(3+); hydron; 3-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)diazenyl]-5-nitro-4-oxidanidyl-benzenesulfonate

Systemtic Name: sodium; 5-[bis(oxidanidyl)amino]-3-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinylidene]-4-oxidanylidene-cyclohexa-1,5-diene-1-sulfonate; chromium(3+); hydron; 3-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)diazenyl]-5-nitro-4-oxidanidyl-benzenesulfonate Openeye Name: chromic; sodium; 5-(dioxidoamino)-3-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)hydrazono]-4-oxo-cyclohexa-1,5-diene-1-sulfonate; hydron; 3-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)azo-5-nitro-4-oxido-benzenesulfonate CAS Name: sodium; chromium(3+); 5-(dioxidoamino)-3-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)hydrazinylidene]-4-oxo-1-cyclohexa-1,5-dienesulfonate; hydron; 3-[(3-methyl-5-oxido-1-phenyl-4-pyrazolyl)azo]-5-nitro-4-oxidobenzenesulfonate IUPAC Name: sodium; chromium(3+); 5-(dioxidoamino)-3-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinylidene]-4-oxocyclohexa-1,5-diene-1-sulfonate; hydron; 3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-4-oxidobenzenesulfonate Traditional Name: chromic; sodium; 5-(dioxidoamino)-4-keto-3-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)hydrazono]cyclohexa-1,5-diene-1-sulfonate; hydron; 3-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)azo-5-nitro-4-oxido-besylate Formula: C32H22CrN10NaO14S2 MolecularWeight: 909.69155

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[H+].[H+].CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])[N+](=O)[O-])S(=O)(=O)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=C(C2=O)N([O-])[O-])S(=O)(=O)[O-])C3=CC=CC=C3.[Na+].[Cr+3]

Isomeric SMILES

[H+].[H+].CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])[N+](=O)[O-])S(=O)(=O)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=C(C2=O)N([O-])[O-])S(=O)(=O)[O-])C3=CC=CC=C3.[Na+].[Cr+3]

InChI

InChI=1S/C16H13N5O7S.C16H11N5O7S.Cr.Na/c2*1-9-14(16(23)20(19-9)10-5-3-2-4-6-10)18-17-12-7-11(29(26,27)28)8-13(15(12)22)21(24)25;;/h2-8,22-23H,1H3,(H,26,27,28);2-8H,1H3,(H,26,27,28);;/q;-2;+3;+1/p-2