cyclopropyl-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: cyclopropyl-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]-(pyridin-3-ylmethyl)azanium Openeye Name: cyclopropyl-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]-(3-pyridylmethyl)ammonium CAS Name: cyclopropyl-[1-[4-(1-pyrazolyl)phenyl]-4-piperidinyl]-(3-pyridinylmethyl)ammonium IUPAC Name: cyclopropyl-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]-(pyridin-3-ylmethyl)azanium Traditional Name: cyclopropyl-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]-(3-pyridylmethyl)ammonium Formula: C23H28N5+ MolecularWeight: 374.50192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC2=CN=CC=C2)C3CCN(CC3)C4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1CC1[NH+](CC2=CN=CC=C2)C3CCN(CC3)C4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C23H27N5/c1-3-19(17-24-12-1)18-27(21-6-7-21)22-10-15-26(16-11-22)20-4-8-23(9-5-20)28-14-2-13-25-28/h1-5,8-9,12-14,17,21-22H,6-7,10-11,15-16,18H2/p+1