3-[[(2R)-1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[(2R)-1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[(2R)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]propyl]-methyl-ammonium CAS Name: 3-[[[(2R)-1-(4-fluorophenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[(2R)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]propyl]-methylazanium Traditional Name: benzyl-[3-[[(2R)-1-(4-fluorophenyl)sulfonylprolyl]amino]propyl]-methyl-ammonium Formula: C22H29FN3O3S+ MolecularWeight: 434.547363

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)F)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNC(=O)[C@H]1CCCN1S(=O)(=O)C2=CC=C(C=C2)F)CC3=CC=CC=C3

InChI

InChI=1S/C22H28FN3O3S/c1-25(17-18-7-3-2-4-8-18)15-6-14-24-22(27)21-9-5-16-26(21)30(28,29)20-12-10-19(23)11-13-20/h2-4,7-8,10-13,21H,5-6,9,14-17H2,1H3,(H,24,27)/p+1/t21-/m1/s1