4-[3-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(2R)-2-(4-ethoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(2R)-2-p-phenetylpyrrolidin-1-ium-1-yl]methyl]phenyl]sulfonylmorpholine Formula: C23H31N2O4S+ MolecularWeight: 431.56824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCC[NH+]2CC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2CCC[NH+]2CC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H30N2O4S/c1-2-29-21-10-8-20(9-11-21)23-7-4-12-24(23)18-19-5-3-6-22(17-19)30(26,27)25-13-15-28-16-14-25/h3,5-6,8-11,17,23H,2,4,7,12-16,18H2,1H3/p+1/t23-/m1/s1