disodium (3Z)-3-[(2,4-dimethylphenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: disodium (3Z)-3-[(2,4-dimethylphenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: disodium (3Z)-3-[(2,4-dimethylphenyl)hydrazono]-4-oxo-naphthalene-2,7-disulfonate CAS Name: disodium (3Z)-3-[(2,4-dimethylphenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonate IUPAC Name: disodium (3Z)-3-[(2,4-dimethylphenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonate Traditional Name: disodium (3Z)-3-[(2,4-dimethylphenyl)hydrazono]-4-keto-naphthalene-2,7-disulfonate Formula: C18H14N2Na2O7S2 MolecularWeight: 480.4225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]

InChI

InChI=1S/C18H16N2O7S2.2Na/c1-10-3-6-15(11(2)7-10)19-20-17-16(29(25,26)27)9-12-8-13(28(22,23)24)4-5-14(12)18(17)21;;/h3-9,19H,1-2H3,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2/b20-17+;;