(2R)-N-(4-morpholin-4-ylphenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(4-morpholin-4-ylphenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(4-morpholinophenyl)propanamide CAS Name: (2R)-N-[4-(4-morpholinyl)phenyl]-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]propanamide IUPAC Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(4-morpholinophenyl)propionamide Formula: C25H34N3O2+ MolecularWeight: 408.55636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)[NH+]3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)N2CCOCC2)[NH+]3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O2/c1-20(27-13-11-22(12-14-27)19-21-5-3-2-4-6-21)25(29)26-23-7-9-24(10-8-23)28-15-17-30-18-16-28/h2-10,20,22H,11-19H2,1H3,(H,26,29)/p+1/t20-/m1/s1