N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-homoveratryl-N-methyl-1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-carboxamide Formula: C23H33N2O4+ MolecularWeight: 401.51912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCC(CC2)C(=O)N(C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCC(CC2)C(=O)N(C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H32N2O4/c1-17-5-7-20(29-17)16-25-13-10-19(11-14-25)23(26)24(2)12-9-18-6-8-21(27-3)22(15-18)28-4/h5-8,15,19H,9-14,16H2,1-4H3/p+1