(3S)-N-[[5-(methoxymethyl)furan-2-yl]methyl]-N-methyl-1-phenethyl-piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-[[5-(methoxymethyl)furan-2-yl]methyl]-N-methyl-1-phenethyl-piperidin-1-ium-3-amine Openeye Name: (3S)-N-[[5-(methoxymethyl)-2-furyl]methyl]-N-methyl-1-phenethyl-piperidin-1-ium-3-amine CAS Name: (3S)-N-[[5-(methoxymethyl)-2-furanyl]methyl]-N-methyl-1-phenethyl-3-piperidin-1-iumamine IUPAC Name: (3S)-N-[[5-(methoxymethyl)furan-2-yl]methyl]-N-methyl-1-phenethylpiperidin-1-ium-3-amine Traditional Name: [5-(methoxymethyl)-2-furyl]methyl-methyl-[(3S)-1-phenethylpiperidin-1-ium-3-yl]amine Formula: C21H31N2O2+ MolecularWeight: 343.48304

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(O1)COC)C2CCC[NH+](C2)CCC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=C(O1)COC)[C@H]2CCC[NH+](C2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H30N2O2/c1-22(16-20-10-11-21(25-20)17-24-2)19-9-6-13-23(15-19)14-12-18-7-4-3-5-8-18/h3-5,7-8,10-11,19H,6,9,12-17H2,1-2H3/p+1/t19-/m0/s1