6-methoxy-3-methyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 6-methoxy-3-methyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]-1-benzofuran-2-carboxamide Openeye Name: 6-methoxy-3-methyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]-3-piperidyl]benzofuran-2-carboxamide CAS Name: 6-methoxy-3-methyl-N-[(3S)-1-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-3-piperidinyl]-2-benzofurancarboxamide IUPAC Name: 6-methoxy-3-methyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]-1-benzofuran-2-carboxamide Traditional Name: 6-methoxy-3-methyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]-3-piperidyl]coumarilamide Formula: C22H23F3N3O3+ MolecularWeight: 434.43153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC(=C2)OC)C(=O)NC3CCCN(C3)C4=[NH+]C=C(C=C4)C(F)(F)F

Isomeric SMILES

CC1=C(OC2=C1C=CC(=C2)OC)C(=O)N[C@H]3CCCN(C3)C4=[NH+]C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H22F3N3O3/c1-13-17-7-6-16(30-2)10-18(17)31-20(13)21(29)27-15-4-3-9-28(12-15)19-8-5-14(11-26-19)22(23,24)25/h5-8,10-11,15H,3-4,9,12H2,1-2H3,(H,27,29)/p+1/t15-/m0/s1