5-methoxy-2-(4-methylphenyl)sulfanyl-4-morpholin-4-yl-benzenediazonium tetrafluoroborate

Systemtic Name: 5-methoxy-2-(4-methylphenyl)sulfanyl-4-morpholin-4-yl-benzenediazonium tetrafluoroborate Openeye Name: 5-methoxy-4-morpholino-2-(p-tolylsulfanyl)benzenediazonium tetrafluoroborate CAS Name: 5-methoxy-2-[(4-methylphenyl)thio]-4-(4-morpholinyl)benzenediazonium tetrafluoroborate IUPAC Name: 5-methoxy-2-(4-methylphenyl)sulfanyl-4-morpholin-4-ylbenzenediazonium tetrafluoroborate Traditional Name: 5-methoxy-4-morpholino-2-(p-tolylthio)benzenediazonium tetrafluoroborate Formula: C18H20BF4N3O2S MolecularWeight: 429.239913

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=CC=C(C=C1)SC2=CC(=C(C=C2[N+]#N)OC)N3CCOCC3

Isomeric SMILES

[B-](F)(F)(F)F.CC1=CC=C(C=C1)SC2=CC(=C(C=C2[N+]#N)OC)N3CCOCC3

InChI

InChI=1S/C18H20N3O2S.BF4/c1-13-3-5-14(6-4-13)24-18-12-16(21-7-9-23-10-8-21)17(22-2)11-15(18)20-19;2-1(3,4)5/h3-6,11-12H,7-10H2,1-2H3;/q+1;-1