sodium 3-[(2E)-2-[(5Z)-5-[(4-nitrophenyl)hydrazinylidene]-4,6-bis(oxidanylidene)cyclohex-2-en-1-ylidene]hydrazinyl]-4-oxidanyl-benzenesulfonate

Systemtic Name: sodium 3-[(2E)-2-[(5Z)-5-[(4-nitrophenyl)hydrazinylidene]-4,6-bis(oxidanylidene)cyclohex-2-en-1-ylidene]hydrazinyl]-4-oxidanyl-benzenesulfonate Openeye Name: sodium 4-hydroxy-3-[(2E)-2-[(5Z)-5-[(4-nitrophenyl)hydrazono]-4,6-dioxo-cyclohex-2-en-1-ylidene]hydrazino]benzenesulfonate CAS Name: sodium 4-hydroxy-3-[(2E)-2-[(5Z)-5-[(4-nitrophenyl)hydrazinylidene]-4,6-dioxo-1-cyclohex-2-enylidene]hydrazinyl]benzenesulfonate IUPAC Name: sodium 4-hydroxy-3-[(2E)-2-[(5Z)-5-[(4-nitrophenyl)hydrazinylidene]-4,6-dioxocyclohex-2-en-1-ylidene]hydrazinyl]benzenesulfonate Traditional Name: sodium 3-[(N'E)-N'-[(5Z)-4,6-diketo-5-[(4-nitrophenyl)hydrazono]cyclohex-2-en-1-ylidene]hydrazino]-4-hydroxy-besylate Formula: C18H12N5NaO8S MolecularWeight: 481.37135

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C(=O)C=CC(=NNC3=C(C=CC(=C3)S(=O)(=O)[O-])O)C2=O)[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1N/N=C\2/C(=O)C=C/C(=N\NC3=C(C=CC(=C3)S(=O)(=O)[O-])O)/C2=O)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C18H13N5O8S.Na/c24-15-7-5-12(32(29,30)31)9-14(15)21-20-13-6-8-16(25)17(18(13)26)22-19-10-1-3-11(4-2-10)23(27)28;/h1-9,19,21,24H,(H,29,30,31);/q;+1/p-1/b20-13+,22-17-;