N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,2-dimethyl-furan-3-carboxamide

Systemtic Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,2-dimethyl-furan-3-carboxamide Openeye Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,2-dimethyl-furan-3-carboxamide CAS Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N,2-dimethyl-3-furancarboxamide IUPAC Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,2-dimethylfuran-3-carboxamide Traditional Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,2-dimethyl-3-furamide Formula: C22H31N2O3+ MolecularWeight: 371.49314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)N(C)CC2CCC[NH+](C2)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CO1)C(=O)N(C)C[C@H]2CCC[NH+](C2)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H30N2O3/c1-17-21(11-14-27-17)22(25)23(2)15-19-5-4-12-24(16-19)13-10-18-6-8-20(26-3)9-7-18/h6-9,11,14,19H,4-5,10,12-13,15-16H2,1-3H3/p+1/t19-/m1/s1