2,2-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3H-1-benzofuran-7-carboxamide

Systemtic Name: 2,2-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3H-1-benzofuran-7-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,2-dimethyl-3H-benzofuran-7-carboxamide CAS Name: 2,2-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3H-benzofuran-7-carboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,2-dimethyl-3H-1-benzofuran-7-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,2-dimethyl-coumaran-7-carboxamide Formula: C23H29N2O2+ MolecularWeight: 365.48856

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC(=C2O1)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=CC=CC(=C2O1)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H28N2O2/c1-23(2)15-18-9-6-10-20(21(18)27-23)22(26)24-19-11-13-25(14-12-19)16-17-7-4-3-5-8-17/h3-10,19H,11-16H2,1-2H3,(H,24,26)/p+1