5-methoxy-3-[4-[3-(3-oxidanidyl-2,4-dihydrobenzimidazol-3-ium-1-yl)propyl]piperazin-1-yl]-1H-indazole

Systemtic Name: 5-methoxy-3-[4-[3-(3-oxidanidyl-2,4-dihydrobenzimidazol-3-ium-1-yl)propyl]piperazin-1-yl]-1H-indazole Openeye Name: 5-methoxy-3-[4-[3-(3-oxido-2,4-dihydrobenzimidazol-3-ium-1-yl)propyl]piperazin-1-yl]-1H-indazole CAS Name: 5-methoxy-3-[4-[3-(3-oxido-2,4-dihydrobenzimidazol-3-ium-1-yl)propyl]-1-piperazinyl]-1H-indazole IUPAC Name: 5-methoxy-3-[4-[3-(3-oxido-2,4-dihydrobenzimidazol-3-ium-1-yl)propyl]piperazin-1-yl]-1H-indazole Traditional Name: 5-methoxy-3-[4-[3-(3-oxido-2,4-dihydrobenzimidazol-3-ium-1-yl)propyl]piperazino]-1H-indazole Formula: C22H28N6O2 MolecularWeight: 408.49672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NN=C2N3CCN(CC3)CCCN4C[N+](=C5C4=CC=CC5)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)NN=C2N3CCN(CC3)CCCN4C[N+](=C5C4=CC=CC5)[O-]

InChI

InChI=1S/C22H28N6O2/c1-30-17-7-8-19-18(15-17)22(24-23-19)26-13-11-25(12-14-26)9-4-10-27-16-28(29)21-6-3-2-5-20(21)27/h2-3,5,7-8,15H,4,6,9-14,16H2,1H3,(H,23,24)