4-[3-(3-methoxyphenyl)propylamino]benzenediazonium sulfate

Systemtic Name: 4-[3-(3-methoxyphenyl)propylamino]benzenediazonium sulfate Openeye Name: 4-[3-(3-methoxyphenyl)propylamino]benzenediazonium sulfate CAS Name: 4-[3-(3-methoxyphenyl)propylamino]benzenediazonium sulfate IUPAC Name: 4-[3-(3-methoxyphenyl)propylamino]benzenediazonium sulfate Traditional Name: 4-[3-(3-methoxyphenyl)propylamino]benzenediazonium sulfate Formula: C16H18N3O5S- MolecularWeight: 364.39622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCCNC2=CC=C(C=C2)[N+]#N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CCCNC2=CC=C(C=C2)[N+]#N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C16H18N3O.H2O4S/c1-20-16-6-2-4-13(12-16)5-3-11-18-14-7-9-15(19-17)10-8-14;1-5(2,3)4/h2,4,6-10,12,18H,3,5,11H2,1H3;(H2,1,2,3,4)/q+1;/p-2