4-azido-4-azidooxy-1-oxidanylidene-naphthalene-2-sulfonic acid; (4-hydroxyphenyl)-[2,3,4-tris(oxidanyl)phenyl]methanone

Systemtic Name: 4-azido-4-azidooxy-1-oxidanylidene-naphthalene-2-sulfonic acid; (4-hydroxyphenyl)-[2,3,4-tris(oxidanyl)phenyl]methanone Openeye Name: 4-azido-4-azidooxy-1-oxo-naphthalene-2-sulfonic acid; (4-hydroxyphenyl)-(2,3,4-trihydroxyphenyl)methanone CAS Name: 4-azido-4-azidooxy-1-oxo-2-naphthalenesulfonic acid; (4-hydroxyphenyl)-(2,3,4-trihydroxyphenyl)methanone IUPAC Name: 4-azido-4-azidooxy-1-oxonaphthalene-2-sulfonic acid; (4-hydroxyphenyl)-(2,3,4-trihydroxyphenyl)methanone Traditional Name: 4-azido-4-azidooxy-1-keto-naphthalene-2-sulfonic acid; (4-hydroxyphenyl)-(2,3,4-trihydroxyphenyl)methanone Formula: C23H16N6O10S MolecularWeight: 568.47234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CC2(N=[N+]=[N-])ON=[N+]=[N-])S(=O)(=O)O.C1=CC(=CC=C1C(=O)C2=C(C(=C(C=C2)O)O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CC2(N=[N+]=[N-])ON=[N+]=[N-])S(=O)(=O)O.C1=CC(=CC=C1C(=O)C2=C(C(=C(C=C2)O)O)O)O

InChI

InChI=1S/C13H10O5.C10H6N6O5S/c14-8-3-1-7(2-4-8)11(16)9-5-6-10(15)13(18)12(9)17;11-14-13-10(21-16-15-12)5-8(22(18,19)20)9(17)6-3-1-2-4-7(6)10/h1-6,14-15,17-18H;1-5H,(H,18,19,20)