8-methyl-2,3-bis(3-nitrophenyl)quinolizin-5-ium bromide

Systemtic Name: 8-methyl-2,3-bis(3-nitrophenyl)quinolizin-5-ium bromide Openeye Name: 8-methyl-2,3-bis(3-nitrophenyl)quinolizin-5-ium bromide CAS Name: 8-methyl-2,3-bis(3-nitrophenyl)quinolizin-5-ium bromide IUPAC Name: 8-methyl-2,3-bis(3-nitrophenyl)quinolizin-5-ium bromide Traditional Name: 8-methyl-2,3-bis(3-nitrophenyl)quinolizin-5-ium bromide Formula: C22H16BrN3O4 MolecularWeight: 466.28414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[N+](C=C1)C=C(C(=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=CC=C4)[N+](=O)[O-].[Br-]

Isomeric SMILES

CC1=CC2=[N+](C=C1)C=C(C(=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=CC=C4)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C22H16N3O4.BrH/c1-15-8-9-23-14-22(17-5-3-7-19(12-17)25(28)29)21(13-20(23)10-15)16-4-2-6-18(11-16)24(26)27;/h2-14H,1H3;1H/q+1;/p-1