N-[(2S)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-4-methoxy-benzamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-4-methoxy-benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-4-methoxy-benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]-4-methoxybenzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-4-methoxybenzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-4-methoxy-benzamide Formula: C20H27N2O3+ MolecularWeight: 343.43998

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=CC=C(C=C2)OC)C3=CC=CO3

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](CNC(=O)C2=CC=C(C=C2)OC)C3=CC=CO3

InChI

InChI=1S/C20H26N2O3/c1-15-9-11-22(12-10-15)18(19-4-3-13-25-19)14-21-20(23)16-5-7-17(24-2)8-6-16/h3-8,13,15,18H,9-12,14H2,1-2H3,(H,21,23)/p+1/t18-/m0/s1