2-diazonio-5-[4-[2,3,4-tris(oxidanyl)phenyl]carbonylphenoxy]sulfonyl-naphthalen-1-olate

Systemtic Name: 2-diazonio-5-[4-[2,3,4-tris(oxidanyl)phenyl]carbonylphenoxy]sulfonyl-naphthalen-1-olate Openeye Name: 2-diazonio-5-[4-(2,3,4-trihydroxybenzoyl)phenoxy]sulfonyl-naphthalen-1-olate CAS Name: 2-diazonio-5-[4-[oxo-(2,3,4-trihydroxyphenyl)methyl]phenoxy]sulfonyl-1-naphthalenolate IUPAC Name: 2-diazonio-5-[4-(2,3,4-trihydroxybenzoyl)phenoxy]sulfonylnaphthalen-1-olate Traditional Name: 2-diazonio-5-[4-(2,3,4-trihydroxybenzoyl)phenoxy]sulfonyl-naphthalen-1-olate Formula: C23H14N2O8S MolecularWeight: 478.43086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2[O-])[N+]#N)C(=C1)S(=O)(=O)OC3=CC=C(C=C3)C(=O)C4=C(C(=C(C=C4)O)O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2[O-])[N+]#N)C(=C1)S(=O)(=O)OC3=CC=C(C=C3)C(=O)C4=C(C(=C(C=C4)O)O)O

InChI

InChI=1S/C23H14N2O8S/c24-25-17-10-8-14-15(21(17)28)2-1-3-19(14)34(31,32)33-13-6-4-12(5-7-13)20(27)16-9-11-18(26)23(30)22(16)29/h1-11,24H,(H2,26,27,28,29)