5-[4-(2-nitroimidazol-1-yl)butyl]phenanthridin-5-ium

Systemtic Name: 5-[4-(2-nitroimidazol-1-yl)butyl]phenanthridin-5-ium Openeye Name: 5-[4-(2-nitroimidazol-1-yl)butyl]phenanthridin-5-ium CAS Name: 5-[4-(2-nitro-1-imidazolyl)butyl]phenanthridin-5-ium IUPAC Name: 5-[4-(2-nitroimidazol-1-yl)butyl]phenanthridin-5-ium Traditional Name: 5-[4-(2-nitroimidazol-1-yl)butyl]phenanthridin-5-ium Formula: C20H19N4O2+ MolecularWeight: 347.39046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=[N+](C3=CC=CC=C23)CCCCN4C=CN=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=[N+](C3=CC=CC=C23)CCCCN4C=CN=C4[N+](=O)[O-]

InChI

InChI=1S/C20H19N4O2/c25-24(26)20-21-11-14-22(20)12-5-6-13-23-15-16-7-1-2-8-17(16)18-9-3-4-10-19(18)23/h1-4,7-11,14-15H,5-6,12-13H2/q+1