4-[(3R)-1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]-1-(2-methylpropyl)piperidin-1-ium

Systemtic Name: 4-[(3R)-1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]-1-(2-methylpropyl)piperidin-1-ium Openeye Name: 4-[(3R)-1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]-1-isobutyl-piperidin-1-ium CAS Name: 4-[(3R)-1-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-3-pyrrolidin-1-iumyl]-1-(2-methylpropyl)piperidin-1-ium IUPAC Name: 4-[(3R)-1-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]-1-(2-methylpropyl)piperidin-1-ium Traditional Name: 4-[(3R)-1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]pyrrolidin-1-ium-3-yl]-1-isobutyl-piperidin-1-ium Formula: C21H40N4+2 MolecularWeight: 348.5691

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C[NH+]2CCC(C2)C3CC[NH+](CC3)CC(C)C)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)C[NH+]2CC[C@@H](C2)C3CC[NH+](CC3)CC(C)C)C

InChI

InChI=1S/C21H38N4/c1-6-25-18(5)21(17(4)22-25)15-24-12-9-20(14-24)19-7-10-23(11-8-19)13-16(2)3/h16,19-20H,6-15H2,1-5H3/p+2/t20-/m0/s1