7-butyl-3-nitro-benzimidazolo[1,2-a]quinolin-12-ium

Systemtic Name: 7-butyl-3-nitro-benzimidazolo[1,2-a]quinolin-12-ium Openeye Name: 7-butyl-3-nitro-benzimidazolo[1,2-a]quinolin-12-ium CAS Name: 7-butyl-3-nitrobenzimidazolo[1,2-a]quinolin-12-ium IUPAC Name: 7-butyl-3-nitrobenzimidazolo[1,2-a]quinolin-12-ium Traditional Name: 7-butyl-3-nitro-benzimidazolo[1,2-a]quinolin-12-ium Formula: C19H18N3O2+ MolecularWeight: 320.36512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=[N+](C3=C(C=C2)C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C41

Isomeric SMILES

CCCCN1C2=[N+](C3=C(C=C2)C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C41

InChI

InChI=1S/C19H18N3O2/c1-2-3-12-20-17-6-4-5-7-18(17)21-16-10-9-15(22(23)24)13-14(16)8-11-19(20)21/h4-11,13H,2-3,12H2,1H3/q+1