N-ethyl-N-(2-methylprop-2-enyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-ethyl-N-(2-methylprop-2-enyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-N-ethyl-N-(2-methylallyl)piperidin-1-ium-4-carboxamide CAS Name: N-ethyl-N-(2-methylprop-2-enyl)-1-[(4-phenylmethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-ethyl-N-(2-methylprop-2-enyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-benzoxybenzyl)-N-ethyl-N-(2-methylallyl)piperidin-1-ium-4-carboxamide Formula: C26H35N2O2+ MolecularWeight: 407.5683

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCN(CC(=C)C)C(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C26H34N2O2/c1-4-28(18-21(2)3)26(29)24-14-16-27(17-15-24)19-22-10-12-25(13-11-22)30-20-23-8-6-5-7-9-23/h5-13,24H,2,4,14-20H2,1,3H3/p+1