N-(2-methoxyethyl)-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]but-3-enamide

Systemtic Name: N-(2-methoxyethyl)-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]but-3-enamide Openeye Name: N-(2-methoxyethyl)-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]but-3-enamide CAS Name: N-(2-methoxyethyl)-N-[[1-[(2-methoxyphenyl)methyl]-4-piperidin-1-iumyl]methyl]-3-butenamide IUPAC Name: N-(2-methoxyethyl)-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]but-3-enamide Traditional Name: N-(2-methoxyethyl)-N-[(1-o-anisylpiperidin-1-ium-4-yl)methyl]but-3-enamide Formula: C21H33N2O3+ MolecularWeight: 361.49832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C(=O)CC=C

Isomeric SMILES

COCCN(CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C(=O)CC=C

InChI

InChI=1S/C21H32N2O3/c1-4-7-21(24)23(14-15-25-2)16-18-10-12-22(13-11-18)17-19-8-5-6-9-20(19)26-3/h4-6,8-9,18H,1,7,10-17H2,2-3H3/p+1