5-diazonio-2-[2-[2-[(4-diazonio-2-oxidanidyl-phenyl)carbonylamino]ethyldisulfanyl]ethylcarbamoyl]phenolate

Systemtic Name: 5-diazonio-2-[2-[2-[(4-diazonio-2-oxidanidyl-phenyl)carbonylamino]ethyldisulfanyl]ethylcarbamoyl]phenolate Openeye Name: 5-diazonio-2-[2-[2-[(4-diazonio-2-oxido-benzoyl)amino]ethyldisulfanyl]ethylcarbamoyl]phenolate CAS Name: 5-diazonio-2-[[2-[2-[[(4-diazonio-2-oxidophenyl)-oxomethyl]amino]ethyldisulfanyl]ethylamino]-oxomethyl]phenolate IUPAC Name: 5-diazonio-2-[2-[2-[(4-diazonio-2-oxidobenzoyl)amino]ethyldisulfanyl]ethylcarbamoyl]phenolate Traditional Name: 5-diazonio-2-[2-[2-[(4-diazonio-2-oxido-benzoyl)amino]ethyldisulfanyl]ethylcarbamoyl]phenolate Formula: C18H16N6O4S2 MolecularWeight: 444.48744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+]#N)[O-])C(=O)NCCSSCCNC(=O)C2=C(C=C(C=C2)[N+]#N)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+]#N)[O-])C(=O)NCCSSCCNC(=O)C2=C(C=C(C=C2)[N+]#N)[O-]

InChI

InChI=1S/C18H16N6O4S2/c19-23-11-1-3-13(15(25)9-11)17(27)21-5-7-29-30-8-6-22-18(28)14-4-2-12(24-20)10-16(14)26/h1-4,9-10H,5-8H2,(H2-2,21,22,25,26,27,28)