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

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-2,3-dihydro-1-benzofuran-5-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,3-dihydrobenzofuran-5-carboxamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-2,3-dihydrobenzofuran-5-carboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)coumaran-5-carboxamide Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC3=C(C=C2)OCC3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC3=C(C=C2)OCC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N2O2/c24-21(18-6-7-20-17(14-18)10-13-25-20)22-19-8-11-23(12-9-19)15-16-4-2-1-3-5-16/h1-7,14,19H,8-13,15H2,(H,22,24)/p+1