3-[3-[1-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]pyrazol-3-yl]phenyl]pyridine

Systemtic Name: 3-[3-[1-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]pyrazol-3-yl]phenyl]pyridine Openeye Name: 3-[3-[1-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]pyrazol-3-yl]phenyl]pyridine CAS Name: 3-[3-[1-[2-[(2S)-1-methyl-2-pyrrolidin-1-iumyl]ethyl]-3-pyrazolyl]phenyl]pyridine IUPAC Name: 3-[3-[1-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]pyrazol-3-yl]phenyl]pyridine Traditional Name: 3-[3-[1-[2-[(2S)-1-methylpyrrolidin-1-ium-2-yl]ethyl]pyrazol-3-yl]phenyl]pyridine Formula: C21H25N4+ MolecularWeight: 333.45

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1CCN2C=CC(=N2)C3=CC=CC(=C3)C4=CN=CC=C4

Isomeric SMILES

C[NH+]1CCC[C@H]1CCN2C=CC(=N2)C3=CC=CC(=C3)C4=CN=CC=C4

InChI

InChI=1S/C21H24N4/c1-24-12-4-8-20(24)9-13-25-14-10-21(23-25)18-6-2-5-17(15-18)19-7-3-11-22-16-19/h2-3,5-7,10-11,14-16,20H,4,8-9,12-13H2,1H3/p+1/t20-/m0/s1