2-diazonio-5-[4-(2-phenylpropan-2-yl)phenoxy]sulfonyl-naphthalen-1-olate

Systemtic Name: 2-diazonio-5-[4-(2-phenylpropan-2-yl)phenoxy]sulfonyl-naphthalen-1-olate Openeye Name: 2-diazonio-5-[4-(1-methyl-1-phenyl-ethyl)phenoxy]sulfonyl-naphthalen-1-olate CAS Name: 2-diazonio-5-[4-(2-phenylpropan-2-yl)phenoxy]sulfonyl-1-naphthalenolate IUPAC Name: 2-diazonio-5-[4-(2-phenylpropan-2-yl)phenoxy]sulfonylnaphthalen-1-olate Traditional Name: 5-(4-cumylphenoxy)sulfonyl-2-diazonio-naphthalen-1-olate Formula: C25H20N2O4S MolecularWeight: 444.5023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N

InChI

InChI=1S/C25H20N2O4S/c1-25(2,17-7-4-3-5-8-17)18-11-13-19(14-12-18)31-32(29,30)23-10-6-9-21-20(23)15-16-22(27-26)24(21)28/h3-16H,1-2H3