disodium (3Z)-3-[[4-(ethylamino)phenyl]hydrazinylidene]-5-oxidanyl-4-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: disodium (3Z)-3-[[4-(ethylamino)phenyl]hydrazinylidene]-5-oxidanyl-4-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: disodium (3Z)-3-[[4-(ethylamino)phenyl]hydrazono]-5-hydroxy-4-oxo-naphthalene-2,7-disulfonate CAS Name: disodium (3Z)-3-[[4-(ethylamino)phenyl]hydrazinylidene]-5-hydroxy-4-oxonaphthalene-2,7-disulfonate IUPAC Name: disodium (3Z)-3-[[4-(ethylamino)phenyl]hydrazinylidene]-5-hydroxy-4-oxonaphthalene-2,7-disulfonate Traditional Name: disodium (3Z)-3-[[4-(ethylamino)phenyl]hydrazono]-5-hydroxy-4-keto-naphthalene-2,7-disulfonate Formula: C18H15N3Na2O8S2 MolecularWeight: 511.43654

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(C=C1)NN=C2C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCNC1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C18H17N3O8S2.2Na/c1-2-19-11-3-5-12(6-4-11)20-21-17-15(31(27,28)29)8-10-7-13(30(24,25)26)9-14(22)16(10)18(17)23;;/h3-9,19-20,22H,2H2,1H3,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/b21-17+;;