[1-[[2-(4-fluoranyl-3-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[[2-(4-fluoranyl-3-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[[2-(4-fluoro-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[[2-(4-fluoro-3-methoxyphenyl)-5-methyl-4-oxazolyl]methyl]-4-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[[2-(4-fluoro-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[[2-(4-fluoro-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-4-yl]-pyrrolidino-methanone Formula: C22H29FN3O3+ MolecularWeight: 402.482363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=C(C=C2)F)OC)C[NH+]3CCC(CC3)C(=O)N4CCCC4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=C(C=C2)F)OC)C[NH+]3CCC(CC3)C(=O)N4CCCC4

InChI

InChI=1S/C22H28FN3O3/c1-15-19(24-21(29-15)17-5-6-18(23)20(13-17)28-2)14-25-11-7-16(8-12-25)22(27)26-9-3-4-10-26/h5-6,13,16H,3-4,7-12,14H2,1-2H3/p+1