disodium (3Z)-4-azanyl-3-[(4-chloranyl-5-methyl-1H-pyrazol-3-yl)hydrazinylidene]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: disodium (3Z)-4-azanyl-3-[(4-chloranyl-5-methyl-1H-pyrazol-3-yl)hydrazinylidene]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-naphthalene-2-sulfonate Openeye Name: disodium (3Z)-4-amino-3-[(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazono]-7-oxidoperoxysulfanyl-5-oxo-naphthalene-2-sulfonate CAS Name: disodium (3Z)-4-amino-3-[(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazinylidene]-7-(oxidodioxythio)-5-oxo-2-naphthalenesulfonate IUPAC Name: disodium (3Z)-4-amino-3-[(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazinylidene]-7-oxidoperoxysulfanyl-5-oxonaphthalene-2-sulfonate Traditional Name: disodium (3Z)-4-amino-3-[(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazono]-5-keto-7-(oxidoperoxythio)naphthalene-2-sulfonate Formula: C14H10ClN5Na2O7S2 MolecularWeight: 505.82104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)NN=C2C(=CC3=CC(=CC(=O)C3=C2N)SOO[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+]

Isomeric SMILES

CC1=C(C(=NN1)N/N=C/2\C(=CC3=CC(=CC(=O)C3=C2N)SOO[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+]

InChI

InChI=1S/C14H12ClN5O7S2.2Na/c1-5-11(15)14(19-17-5)20-18-13-9(29(23,24)25)3-6-2-7(28-27-26-22)4-8(21)10(6)12(13)16;;/h2-4,22H,16H2,1H3,(H2,17,19,20)(H,23,24,25);;/q;2*+1/p-2/b18-13+;;