(2R)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methoxyphenyl)propanamide

Systemtic Name: (2R)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methoxyphenyl)propanamide Openeye Name: (2R)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methoxyphenyl)propanamide CAS Name: (2R)-2-[4-(2-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-methoxyphenyl)propanamide IUPAC Name: (2R)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methoxyphenyl)propanamide Traditional Name: (2R)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methoxyphenyl)propionamide Formula: C20H25FN3O4S+ MolecularWeight: 422.493603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1OC)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1OC)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H24FN3O4S/c1-15(20(25)22-17-8-4-5-9-18(17)28-2)23-11-13-24(14-12-23)29(26,27)19-10-6-3-7-16(19)21/h3-10,15H,11-14H2,1-2H3,(H,22,25)/p+1/t15-/m1/s1