5-[(4-phenylmethoxypiperidin-1-ium-1-yl)methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(4-phenylmethoxypiperidin-1-ium-1-yl)methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(4-benzyloxypiperidin-1-ium-1-yl)methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[(4-phenylmethoxy-1-piperidin-1-iumyl)methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4-phenylmethoxypiperidin-1-ium-1-yl)methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[(4-benzoxypiperidin-1-ium-1-yl)methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole Formula: C24H30N3O5+ MolecularWeight: 440.5121

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)OCC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)OCC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C24H29N3O5/c1-28-20-10-9-19(22(29-2)23(20)30-3)24-25-21(32-26-24)15-27-13-11-18(12-14-27)31-16-17-7-5-4-6-8-17/h4-10,18H,11-16H2,1-3H3/p+1