sodium 3-[2-[(8E)-8-(methylsulfonylaminohydrazinylidene)-4-oxidanylidene-naphthalen-1-yl]-5-nitro-phenyl]sulfonylpropane-1-sulfonate

Systemtic Name: sodium 3-[2-[(8E)-8-(methylsulfonylaminohydrazinylidene)-4-oxidanylidene-naphthalen-1-yl]-5-nitro-phenyl]sulfonylpropane-1-sulfonate Openeye Name: sodium 3-[2-[(8E)-8-(methanesulfonamidohydrazono)-4-oxo-1-naphthyl]-5-nitro-phenyl]sulfonylpropane-1-sulfonate CAS Name: sodium 3-[2-[(8E)-8-(methanesulfonamidohydrazinylidene)-4-oxo-1-naphthalenyl]-5-nitrophenyl]sulfonyl-1-propanesulfonate IUPAC Name: sodium 3-[2-[(8E)-8-(methanesulfonamidohydrazinylidene)-4-oxonaphthalen-1-yl]-5-nitrophenyl]sulfonylpropane-1-sulfonate Traditional Name: sodium 3-[2-[(8E)-4-keto-8-(methanesulfonamidohydrazono)-1-naphthyl]-5-nitro-phenyl]sulfonylpropane-1-sulfonate Formula: C20H19N4NaO10S3 MolecularWeight: 594.57043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NNN=C1C=CC=C2C1=C(C=CC2=O)C3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)CCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CS(=O)(=O)NN/N=C/1\C=CC=C2C1=C(C=CC2=O)C3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)CCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H20N4O10S3.Na/c1-35(28,29)23-22-21-17-5-2-4-16-18(25)9-8-15(20(16)17)14-7-6-13(24(26)27)12-19(14)36(30,31)10-3-11-37(32,33)34;/h2,4-9,12,22-23H,3,10-11H2,1H3,(H,32,33,34);/q;+1/p-1/b21-17+;