N-cyclopropyl-3-[(3R)-1-[(3-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-cyclopropyl-3-[(3R)-1-[(3-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]propanamide Openeye Name: 3-[(3R)-1-[(3-benzyloxyphenyl)methyl]piperidin-1-ium-3-yl]-N-cyclopropyl-propanamide CAS Name: N-cyclopropyl-3-[(3R)-1-[(3-phenylmethoxyphenyl)methyl]-3-piperidin-1-iumyl]propanamide IUPAC Name: N-cyclopropyl-3-[(3R)-1-[(3-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]propanamide Traditional Name: 3-[(3R)-1-(3-benzoxybenzyl)piperidin-1-ium-3-yl]-N-cyclopropyl-propionamide Formula: C25H33N2O2+ MolecularWeight: 393.54172

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC(=CC=C2)OCC3=CC=CC=C3)CCC(=O)NC4CC4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC(=CC=C2)OCC3=CC=CC=C3)CCC(=O)NC4CC4

InChI

InChI=1S/C25H32N2O2/c28-25(26-23-12-13-23)14-11-20-9-5-15-27(17-20)18-22-8-4-10-24(16-22)29-19-21-6-2-1-3-7-21/h1-4,6-8,10,16,20,23H,5,9,11-15,17-19H2,(H,26,28)/p+1/t20-/m1/s1