4,5-diacetyloxy-3-phenyldiazenyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 4,5-diacetyloxy-3-phenyldiazenyl-naphthalene-2,7-disulfonic acid Openeye Name: 4,5-diacetoxy-3-phenylazo-naphthalene-2,7-disulfonic acid CAS Name: 4,5-diacetyloxy-3-phenyldiazenylnaphthalene-2,7-disulfonic acid IUPAC Name: 4,5-diacetyloxy-3-phenyldiazenylnaphthalene-2,7-disulfonic acid Traditional Name: 4,5-diacetoxy-3-phenylazo-naphthalene-2,7-disulfonic acid Formula: C20H16N2O10S2 MolecularWeight: 508.47844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=C2OC(=O)C)N=NC3=CC=CC=C3)S(=O)(=O)O

Isomeric SMILES

CC(=O)OC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=C2OC(=O)C)N=NC3=CC=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C20H16N2O10S2/c1-11(23)31-16-10-15(33(25,26)27)8-13-9-17(34(28,29)30)19(20(18(13)16)32-12(2)24)22-21-14-6-4-3-5-7-14/h3-10H,1-2H3,(H,25,26,27)(H,28,29,30)