methyl-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propyl]-[1-(3-pyrazol-1-ylphenyl)piperidin-4-yl]azanium

Systemtic Name: methyl-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propyl]-[1-(3-pyrazol-1-ylphenyl)piperidin-4-yl]azanium Openeye Name: methyl-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propyl]-[1-(3-pyrazol-1-ylphenyl)-4-piperidyl]ammonium CAS Name: methyl-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propyl]-[1-[3-(1-pyrazolyl)phenyl]-4-piperidinyl]ammonium IUPAC Name: methyl-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propyl]-[1-(3-pyrazol-1-ylphenyl)piperidin-4-yl]azanium Traditional Name: methyl-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propyl]-[1-(3-pyrazol-1-ylphenyl)-4-piperidyl]ammonium Formula: C22H32N6+2 MolecularWeight: 380.52968

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)CCC[NH+](C)C2CCN(CC2)C3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

C[N+]1=C(NC=C1)CCC[NH+](C)C2CCN(CC2)C3=CC=CC(=C3)N4C=CC=N4

InChI

InChI=1S/C22H30N6/c1-25(13-4-8-22-23-12-17-26(22)2)19-9-15-27(16-10-19)20-6-3-7-21(18-20)28-14-5-11-24-28/h3,5-7,11-12,14,17-19H,4,8-10,13,15-16H2,1-2H3/p+2