methyl-(pyrazin-2-ylmethyl)-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]azanium

Systemtic Name: methyl-(pyrazin-2-ylmethyl)-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]azanium Openeye Name: methyl-(pyrazin-2-ylmethyl)-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]ammonium CAS Name: methyl-(2-pyrazinylmethyl)-[1-[4-(1-pyrazolyl)phenyl]-4-piperidinyl]ammonium IUPAC Name: methyl-(pyrazin-2-ylmethyl)-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]azanium Traditional Name: methyl-(pyrazin-2-ylmethyl)-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]ammonium Formula: C20H25N6+ MolecularWeight: 349.4527

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC=CN=C1)C2CCN(CC2)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C[NH+](CC1=NC=CN=C1)C2CCN(CC2)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C20H24N6/c1-24(16-17-15-21-10-11-22-17)18-7-13-25(14-8-18)19-3-5-20(6-4-19)26-12-2-9-23-26/h2-6,9-12,15,18H,7-8,13-14,16H2,1H3/p+1