3-[1-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperidin-1-ium-4-yl]oxy-N-(phenylmethyl)benzamide

Systemtic Name: 3-[1-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperidin-1-ium-4-yl]oxy-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-[1-(2,3-dihydrobenzofuran-5-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: 3-[[1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-piperidin-1-iumyl]oxy]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-[1-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-benzyl-3-[1-(coumaran-5-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C28H31N2O3+ MolecularWeight: 443.55734

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3)CC4=CC5=C(C=C4)OCC5

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3)CC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C28H30N2O3/c31-28(29-19-21-5-2-1-3-6-21)24-7-4-8-26(18-24)33-25-11-14-30(15-12-25)20-22-9-10-27-23(17-22)13-16-32-27/h1-10,17-18,25H,11-16,19-20H2,(H,29,31)/p+1