disodium (3E)-6-azanyl-3-[(4-chloranyl-5-methyl-2-sulfonato-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: disodium (3E)-6-azanyl-3-[(4-chloranyl-5-methyl-2-sulfonato-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: disodium (3E)-6-amino-3-[(4-chloro-5-methyl-2-sulfonato-phenyl)hydrazono]-4-oxo-naphthalene-2-sulfonate CAS Name: disodium (3E)-6-amino-3-[(4-chloro-5-methyl-2-sulfonatophenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonate IUPAC Name: disodium (3E)-6-amino-3-[(4-chloro-5-methyl-2-sulfonatophenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonate Traditional Name: disodium (3E)-6-amino-3-[(4-chloro-5-methyl-2-sulfonato-phenyl)hydrazono]-4-keto-naphthalene-2-sulfonate Formula: C17H12ClN3Na2O7S2 MolecularWeight: 515.85562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])NN=C2C(=CC3=C(C2=O)C=C(C=C3)N)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C(=CC3=C(C2=O)C=C(C=C3)N)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C17H14ClN3O7S2.2Na/c1-8-4-13(14(7-12(8)18)29(23,24)25)20-21-16-15(30(26,27)28)5-9-2-3-10(19)6-11(9)17(16)22;;/h2-7,20H,19H2,1H3,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2/b21-16-;;