sodium 6-azanylidene-4-oxidanylidene-5-[2-[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinyl]naphthalene-2-sulfonate

Systemtic Name: sodium 6-azanylidene-4-oxidanylidene-5-[2-[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinyl]naphthalene-2-sulfonate Openeye Name: sodium 6-imino-4-oxo-5-[2-[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazino]naphthalene-2-sulfonate CAS Name: sodium 6-imino-4-oxo-5-[[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazo]-2-naphthalenesulfonate IUPAC Name: sodium 6-imino-4-oxo-5-[2-[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinyl]naphthalene-2-sulfonate Traditional Name: sodium 6-imino-4-keto-5-[N'-[2-sulfo-4-(2-sulfoxyethylsulfonyl)phenyl]hydrazino]naphthalene-2-sulfonate Formula: C18H16N3NaO13S4 MolecularWeight: 633.58171

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)[O-])NNC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O.[Na+]

Isomeric SMILES

C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)[O-])NNC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C18H17N3O13S4.Na/c19-13-3-1-10-7-12(36(25,26)27)8-15(22)17(10)18(13)21-20-14-4-2-11(9-16(14)37(28,29)30)35(23,24)6-5-34-38(31,32)33;/h1-4,7-9,19-21H,5-6H2,(H,25,26,27)(H,28,29,30)(H,31,32,33);/q;+1/p-1