disodium (3E)-3-[(2,4-dimethyl-5-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-1-sulfonate

Systemtic Name: disodium (3E)-3-[(2,4-dimethyl-5-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-1-sulfonate Openeye Name: disodium (3E)-3-[(2,4-dimethyl-5-sulfo-phenyl)hydrazono]-4-oxo-naphthalene-1-sulfonate CAS Name: disodium (3E)-3-[(2,4-dimethyl-5-sulfophenyl)hydrazinylidene]-4-oxo-1-naphthalenesulfonate IUPAC Name: disodium (3E)-3-[(2,4-dimethyl-5-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-1-sulfonate Traditional Name: disodium (3E)-3-[(2,4-dimethyl-5-sulfo-phenyl)hydrazono]-4-keto-naphthalene-1-sulfonate Formula: C18H15N2Na2O7S2+ MolecularWeight: 481.43044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NN=C2C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-])S(=O)(=O)O)C.[Na+].[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1N/N=C/2\C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-])S(=O)(=O)O)C.[Na+].[Na+]

InChI

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