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

Systemtic Name: 4-[(3R)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]pyrrolidin-3-yl]-1-(2-methylpropyl)piperidin-1-ium Openeye Name: 4-[(3R)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]pyrrolidin-3-yl]-1-isobutyl-piperidin-1-ium CAS Name: 4-[(3R)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-3-pyrrolidinyl]-1-(2-methylpropyl)piperidin-1-ium IUPAC Name: 4-[(3R)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]pyrrolidin-3-yl]-1-(2-methylpropyl)piperidin-1-ium Traditional Name: 4-[(3R)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]pyrrolidin-3-yl]-1-isobutyl-piperidin-1-ium Formula: C18H33N4O2S+ MolecularWeight: 369.54522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)N2CCC(C2)C3CC[NH+](CC3)CC(C)C

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N2CC[C@@H](C2)C3CC[NH+](CC3)CC(C)C

InChI

InChI=1S/C18H32N4O2S/c1-13(2)11-21-8-5-16(6-9-21)17-7-10-22(12-17)25(23,24)18-14(3)19-20-15(18)4/h13,16-17H,5-12H2,1-4H3,(H,19,20)/p+1/t17-/m0/s1