tetrasodium 7-oxidanidylperoxysulfanyl-3-[[5-[(3-oxidanidylperoxysulfanyl-6-sulfonato-naphthalen-2-yl)carbamoyl]thiophen-2-yl]carbonylamino]naphthalene-2-sulfonate

Systemtic Name: tetrasodium 7-oxidanidylperoxysulfanyl-3-[[5-[(3-oxidanidylperoxysulfanyl-6-sulfonato-naphthalen-2-yl)carbamoyl]thiophen-2-yl]carbonylamino]naphthalene-2-sulfonate Openeye Name: tetrasodium 7-oxidoperoxysulfanyl-3-[[5-[(3-oxidoperoxysulfanyl-6-sulfonato-2-naphthyl)carbamoyl]thiophene-2-carbonyl]amino]naphthalene-2-sulfonate CAS Name: tetrasodium 7-(oxidodioxythio)-3-[[[5-[[[3-(oxidodioxythio)-6-sulfonato-2-naphthalenyl]amino]-oxomethyl]-2-thiophenyl]-oxomethyl]amino]-2-naphthalenesulfonate IUPAC Name: tetrasodium 7-oxidoperoxysulfanyl-3-[[5-[(3-oxidoperoxysulfanyl-6-sulfonatonaphthalen-2-yl)carbamoyl]thiophene-2-carbonyl]amino]naphthalene-2-sulfonate Traditional Name: tetrasodium 7-(oxidoperoxythio)-3-[[5-[[3-(oxidoperoxythio)-6-sulfonato-2-naphthyl]carbamoyl]thiophene-2-carbonyl]amino]naphthalene-2-sulfonate Formula: C26H14N2Na4O14S5 MolecularWeight: 830.67844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=CC(=C(C=C21)NC(=O)C3=CC=C(S3)C(=O)NC4=C(C=C5C=C(C=CC5=C4)S(=O)(=O)[O-])SOO[O-])S(=O)(=O)[O-])SOO[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC2=CC(=C(C=C21)NC(=O)C3=CC=C(S3)C(=O)NC4=C(C=C5C=C(C=CC5=C4)S(=O)(=O)[O-])SOO[O-])S(=O)(=O)[O-])SOO[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C26H18N2O14S5.4Na/c29-25(27-19-9-14-2-4-18(46(33,34)35)8-16(14)11-23(19)45-42-40-32)21-5-6-22(43-21)26(30)28-20-10-13-1-3-17(44-41-39-31)7-15(13)12-24(20)47(36,37)38;;;;/h1-12,31-32H,(H,27,29)(H,28,30)(H,33,34,35)(H,36,37,38);;;;/q;4*+1/p-4