2-nitro-5-prop-2-enyl-pyrido[1,2-a]benzimidazol-10-ium bromide

Systemtic Name: 2-nitro-5-prop-2-enyl-pyrido[1,2-a]benzimidazol-10-ium bromide Openeye Name: 5-allyl-2-nitro-pyrido[1,2-a]benzimidazol-10-ium bromide CAS Name: 2-nitro-5-prop-2-enylpyrido[1,2-a]benzimidazol-10-ium bromide IUPAC Name: 2-nitro-5-prop-2-enylpyrido[1,2-a]benzimidazol-10-ium bromide Traditional Name: 5-allyl-2-nitro-pyrido[1,2-a]benzimidazol-10-ium bromide Formula: C14H12BrN3O2 MolecularWeight: 334.16798

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=[N+](C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C31.[Br-]

Isomeric SMILES

C=CCN1C2=[N+](C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C31.[Br-]

InChI

InChI=1S/C14H12N3O2.BrH/c1-2-9-15-12-5-3-4-6-13(12)16-10-11(17(18)19)7-8-14(15)16;/h2-8,10H,1,9H2;1H/q+1;/p-1