N-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-N-methyl-1-[(2R)-1-methylpyrrolidin-1-ium-2-yl]methanamine

Systemtic Name: N-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-N-methyl-1-[(2R)-1-methylpyrrolidin-1-ium-2-yl]methanamine Openeye Name: N-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-N-methyl-1-[(2R)-1-methylpyrrolidin-1-ium-2-yl]methanamine CAS Name: N-[[2-ethylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl]-N-methyl-1-[(2R)-1-methyl-2-pyrrolidin-1-iumyl]methanamine IUPAC Name: N-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-N-methyl-1-[(2R)-1-methylpyrrolidin-1-ium-2-yl]methanamine Traditional Name: [2-esyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-methyl-[[(2R)-1-methylpyrrolidin-1-ium-2-yl]methyl]amine Formula: C22H35N4O2S+ MolecularWeight: 419.6039

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)CN(C)CC3CCC[NH+]3C

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)CN(C)C[C@H]3CCC[NH+]3C

InChI

InChI=1S/C22H34N4O2S/c1-4-29(27,28)22-23-16-21(18-24(2)17-20-13-9-14-25(20)3)26(22)15-8-12-19-10-6-5-7-11-19/h5-7,10-11,16,20H,4,8-9,12-15,17-18H2,1-3H3/p+1/t20-/m1/s1