1-[(5-methyl-1H-pyrazol-3-yl)methyl]-4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-ium

Systemtic Name: 1-[(5-methyl-1H-pyrazol-3-yl)methyl]-4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-ium Openeye Name: 1-[(5-methyl-1H-pyrazol-3-yl)methyl]-4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-ium CAS Name: 1-[(5-methyl-1H-pyrazol-3-yl)methyl]-4-[(3R)-1-phenethyl-3-pyrrolidin-1-iumyl]piperidin-1-ium IUPAC Name: 1-[(5-methyl-1H-pyrazol-3-yl)methyl]-4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-ium Traditional Name: 1-[(5-methyl-1H-pyrazol-3-yl)methyl]-4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-ium Formula: C22H34N4+2 MolecularWeight: 354.53216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C[NH+]2CCC(CC2)C3CC[NH+](C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1)C[NH+]2CCC(CC2)[C@H]3CC[NH+](C3)CCC4=CC=CC=C4

InChI

InChI=1S/C22H32N4/c1-18-15-22(24-23-18)17-26-12-8-20(9-13-26)21-10-14-25(16-21)11-7-19-5-3-2-4-6-19/h2-6,15,20-21H,7-14,16-17H2,1H3,(H,23,24)/p+2/t21-/m0/s1