1-[(3-phenoxyphenyl)methyl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-phenoxyphenyl)methyl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: N-isopropyl-1-[(3-phenoxyphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-phenoxyphenyl)methyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-phenoxyphenyl)methyl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: N-isopropyl-1-(3-phenoxybenzyl)piperidin-1-ium-4-carboxamide Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)CC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)CC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-17(2)23-22(25)19-11-13-24(14-12-19)16-18-7-6-10-21(15-18)26-20-8-4-3-5-9-20/h3-10,15,17,19H,11-14,16H2,1-2H3,(H,23,25)/p+1