2-diazonio-4-[2-(1-phenylpropyl)phenoxy]sulfonyl-naphthalen-1-olate

Systemtic Name: 2-diazonio-4-[2-(1-phenylpropyl)phenoxy]sulfonyl-naphthalen-1-olate Openeye Name: 2-diazonio-4-[2-(1-phenylpropyl)phenoxy]sulfonyl-naphthalen-1-olate CAS Name: 2-diazonio-4-[2-(1-phenylpropyl)phenoxy]sulfonyl-1-naphthalenolate IUPAC Name: 2-diazonio-4-[2-(1-phenylpropyl)phenoxy]sulfonylnaphthalen-1-olate Traditional Name: 2-diazonio-4-[2-(1-phenylpropyl)phenoxy]sulfonyl-naphthalen-1-olate Formula: C25H20N2O4S MolecularWeight: 444.5023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C2=CC=CC=C2OS(=O)(=O)C3=CC(=C(C4=CC=CC=C43)[O-])[N+]#N

Isomeric SMILES

CCC(C1=CC=CC=C1)C2=CC=CC=C2OS(=O)(=O)C3=CC(=C(C4=CC=CC=C43)[O-])[N+]#N

InChI

InChI=1S/C25H20N2O4S/c1-2-18(17-10-4-3-5-11-17)19-12-8-9-15-23(19)31-32(29,30)24-16-22(27-26)25(28)21-14-7-6-13-20(21)24/h3-16,18H,2H2,1H3