1-[3-(2-nitroimidazol-1-yl)propyl]quinolin-1-ium

Systemtic Name: 1-[3-(2-nitroimidazol-1-yl)propyl]quinolin-1-ium Openeye Name: 1-[3-(2-nitroimidazol-1-yl)propyl]quinolin-1-ium CAS Name: 1-[3-(2-nitro-1-imidazolyl)propyl]quinolin-1-ium IUPAC Name: 1-[3-(2-nitroimidazol-1-yl)propyl]quinolin-1-ium Traditional Name: 1-[3-(2-nitroimidazol-1-yl)propyl]quinolin-1-ium Formula: C15H15N4O2+ MolecularWeight: 283.3052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[N+]2CCCN3C=CN=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[N+]2CCCN3C=CN=C3[N+](=O)[O-]

InChI

InChI=1S/C15H15N4O2/c20-19(21)15-16-8-12-18(15)11-4-10-17-9-3-6-13-5-1-2-7-14(13)17/h1-3,5-9,12H,4,10-11H2/q+1