1-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole

Systemtic Name: 1-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole Openeye Name: 1-[(2-fluorophenyl)methyl]-2-isopropylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole CAS Name: 1-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-5-(1-pyrrolidin-1-iumylmethyl)imidazole IUPAC Name: 1-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole Traditional Name: 1-(2-fluorobenzyl)-2-isopropylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole Formula: C18H25FN3O2S+ MolecularWeight: 366.473403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)C[NH+]3CCCC3

Isomeric SMILES

CC(C)S(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)C[NH+]3CCCC3

InChI

InChI=1S/C18H24FN3O2S/c1-14(2)25(23,24)18-20-11-16(13-21-9-5-6-10-21)22(18)12-15-7-3-4-8-17(15)19/h3-4,7-8,11,14H,5-6,9-10,12-13H2,1-2H3/p+1