disodium (3E)-3-[(2-methylphenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: disodium (3E)-3-[(2-methylphenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: disodium (3E)-3-(o-tolylhydrazono)-4-oxo-naphthalene-2,7-disulfonate CAS Name: disodium (3E)-3-[(2-methylphenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonate IUPAC Name: disodium (3E)-3-[(2-methylphenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonate Traditional Name: disodium (3E)-4-keto-3-(o-tolylhydrazono)naphthalene-2,7-disulfonate Formula: C17H12N2Na2O7S2 MolecularWeight: 466.39592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NN=C2C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C17H14N2O7S2.2Na/c1-10-4-2-3-5-14(10)18-19-16-15(28(24,25)26)9-11-8-12(27(21,22)23)6-7-13(11)17(16)20;;/h2-9,18H,1H3,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2/b19-16-;;