6,7-dimethoxy-1-methyl-5-nitro-quinolin-1-ium-4-carbaldehyde tetrafluoroborate

Systemtic Name: 6,7-dimethoxy-1-methyl-5-nitro-quinolin-1-ium-4-carbaldehyde tetrafluoroborate Openeye Name: 6,7-dimethoxy-1-methyl-5-nitro-quinolin-1-ium-4-carbaldehyde tetrafluoroborate CAS Name: 6,7-dimethoxy-1-methyl-5-nitro-4-quinolin-1-iumcarboxaldehyde tetrafluoroborate IUPAC Name: 6,7-dimethoxy-1-methyl-5-nitroquinolin-1-ium-4-carbaldehyde tetrafluoroborate Traditional Name: 6,7-dimethoxy-1-methyl-5-nitro-quinolin-1-ium-4-carbaldehyde tetrafluoroborate Formula: C13H13BF4N2O5 MolecularWeight: 364.057333

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1=C2C=C(C(=C(C2=C(C=C1)C=O)[N+](=O)[O-])OC)OC

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1=C2C=C(C(=C(C2=C(C=C1)C=O)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C13H13N2O5.BF4/c1-14-5-4-8(7-16)11-9(14)6-10(19-2)13(20-3)12(11)15(17)18;2-1(3,4)5/h4-7H,1-3H3;/q+1;-1