[4-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [4-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [4-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [4-(2-imidazo[1,2-a]pyridinylmethoxy)phenyl]methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [4-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzyl]-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C21H28N4O+2 MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH2+]CC2=CC=C(C=C2)OCC3=CN4C=CC=CC4=N3

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+]CC2=CC=C(C=C2)OCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C21H26N4O/c1-24-12-9-18(10-13-24)22-14-17-5-7-20(8-6-17)26-16-19-15-25-11-3-2-4-21(25)23-19/h2-8,11,15,18,22H,9-10,12-14,16H2,1H3/p+2