4-ethanoyl-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-ethanoyl-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-acetyl-N-isobutyl-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]benzamide CAS Name: 4-acetyl-N-[[1-[(2-methoxyphenyl)methyl]-4-piperidin-1-iumyl]methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-acetyl-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)benzamide Traditional Name: 4-acetyl-N-isobutyl-N-[(1-o-anisylpiperidin-1-ium-4-yl)methyl]benzamide Formula: C27H37N2O3+ MolecularWeight: 437.59428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC(C)CN(CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C27H36N2O3/c1-20(2)17-29(27(31)24-11-9-23(10-12-24)21(3)30)18-22-13-15-28(16-14-22)19-25-7-5-6-8-26(25)32-4/h5-12,20,22H,13-19H2,1-4H3/p+1