1-[diazonio(phenyl)amino]-3-methoxy-benzene sulfate

Systemtic Name: 1-[diazonio(phenyl)amino]-3-methoxy-benzene sulfate Openeye Name: 1-(N-diazonioanilino)-3-methoxy-benzene sulfate CAS Name: 1-(N-diazonioanilino)-3-methoxybenzene sulfate IUPAC Name: 1-(N-diazonioanilino)-3-methoxybenzene sulfate Traditional Name: 1-(N-diazonioanilino)-3-methoxy-benzene sulfate Formula: C26H24N6O6S MolecularWeight: 548.57036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(C2=CC=CC=C2)[N+]#N.COC1=CC=CC(=C1)N(C2=CC=CC=C2)[N+]#N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N(C2=CC=CC=C2)[N+]#N.COC1=CC=CC(=C1)N(C2=CC=CC=C2)[N+]#N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C13H12N3O.H2O4S/c2*1-17-13-9-5-8-12(10-13)16(15-14)11-6-3-2-4-7-11;1-5(2,3)4/h2*2-10H,1H3;(H2,1,2,3,4)/q2*+1;/p-2