N-(3-morpholin-4-ylpropyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-N-(3-morpholinopropyl)piperidin-1-ium-4-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-1-[(4-phenylmethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(3-morpholin-4-ylpropyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-benzoxybenzyl)-N-(3-morpholinopropyl)piperidin-1-ium-4-carboxamide Formula: C27H38N3O3+ MolecularWeight: 452.60892

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCCCN2CCOCC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCCCN2CCOCC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H37N3O3/c31-27(28-13-4-14-29-17-19-32-20-18-29)25-11-15-30(16-12-25)21-23-7-9-26(10-8-23)33-22-24-5-2-1-3-6-24/h1-3,5-10,25H,4,11-22H2,(H,28,31)/p+1