3-butoxycarbonyl-9H-pyrido[3,4-b]indole-6-diazonium tetrafluoroborate

Systemtic Name: 3-butoxycarbonyl-9H-pyrido[3,4-b]indole-6-diazonium tetrafluoroborate Openeye Name: 3-butoxycarbonyl-9H-pyrido[3,4-b]indole-6-diazonium tetrafluoroborate CAS Name: 3-[butoxy(oxo)methyl]-9H-pyrido[3,4-b]indole-6-diazonium tetrafluoroborate IUPAC Name: 3-butoxycarbonyl-9H-pyrido[3,4-b]indole-6-diazonium tetrafluoroborate Traditional Name: 3-butoxycarbonyl-9H-$b-carboline-6-diazonium tetrafluoroborate Formula: C16H15BF4N4O2 MolecularWeight: 382.120513

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCOC(=O)C1=NC=C2C(=C1)C3=C(N2)C=CC(=C3)[N+]#N

Isomeric SMILES

[B-](F)(F)(F)F.CCCCOC(=O)C1=NC=C2C(=C1)C3=C(N2)C=CC(=C3)[N+]#N

InChI

InChI=1S/C16H14N4O2.BF4/c1-2-3-6-22-16(21)14-8-12-11-7-10(20-17)4-5-13(11)19-15(12)9-18-14;2-1(3,4)5/h4-5,7-9H,2-3,6H2,1H3;/q;-1/p+1