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

Systemtic Name: 7-ethyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride Openeye Name: 7-ethyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride CAS Name: 7-ethyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride IUPAC Name: 7-ethyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride Traditional Name: 7-ethyl-3-nitro-7a,11a-dihydrobenzimidazolo[1,2-a]quinolin-12-ium chloride Formula: C17H16ClN3O2 MolecularWeight: 329.78084

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2C=CC=CC2[N+]3=C1C=CC4=C3C=CC(=C4)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CCN1C2C=CC=CC2[N+]3=C1C=CC4=C3C=CC(=C4)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C17H16N3O2.ClH/c1-2-18-15-5-3-4-6-16(15)19-14-9-8-13(20(21)22)11-12(14)7-10-17(18)19;/h3-11,15-16H,2H2,1H3;1H/q+1;/p-1