7-methyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride

Systemtic Name: 7-methyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride Openeye Name: 7-methyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride CAS Name: 7-methyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride IUPAC Name: 7-methyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride Traditional Name: 7-methyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2C=CC=CC2[N+]3=C1C=CC4=C3C=CC(=C4)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CN1C2C=CC=CC2[N+]3=C1C=CC4=C3C=CC(=C4)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C16H14N3O2.ClH/c1-17-14-4-2-3-5-15(14)18-13-8-7-12(19(20)21)10-11(13)6-9-16(17)18;/h2-10,14-15H,1H3;1H/q+1;/p-1