N-[[1-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-4-(3-fluorophenyl)piperidin-4-yl]methyl]-2-methoxy-6-oxidanyl-benzamide

Systemtic Name: N-[[1-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-4-(3-fluorophenyl)piperidin-4-yl]methyl]-2-methoxy-6-oxidanyl-benzamide Openeye Name: N-[[1-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-4-(3-fluorophenyl)-4-piperidyl]methyl]-2-hydroxy-6-methoxy-benzamide CAS Name: N-[[1-[(2,3-dimethyl-1-imidazol-3-iumyl)sulfonyl]-4-(3-fluorophenyl)-4-piperidinyl]methyl]-2-hydroxy-6-methoxybenzamide IUPAC Name: N-[[1-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-4-(3-fluorophenyl)piperidin-4-yl]methyl]-2-hydroxy-6-methoxybenzamide Traditional Name: N-[[1-(2,3-dimethylimidazol-3-ium-1-yl)sulfonyl-4-(3-fluorophenyl)-4-piperidyl]methyl]-2-hydroxy-6-methoxy-benzamide Formula: C25H30FN4O5S+ MolecularWeight: 517.592903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1S(=O)(=O)N2CCC(CC2)(CNC(=O)C3=C(C=CC=C3OC)O)C4=CC(=CC=C4)F)C

Isomeric SMILES

CC1=[N+](C=CN1S(=O)(=O)N2CCC(CC2)(CNC(=O)C3=C(C=CC=C3OC)O)C4=CC(=CC=C4)F)C

InChI

InChI=1S/C25H29FN4O5S/c1-18-28(2)14-15-30(18)36(33,34)29-12-10-25(11-13-29,19-6-4-7-20(26)16-19)17-27-24(32)23-21(31)8-5-9-22(23)35-3/h4-9,14-16H,10-13,17H2,1-3H3,(H-,27,31,32)/p+1