(2R)-N-(4-morpholin-4-ylphenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(4-morpholin-4-ylphenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)propanamide Openeye Name: (2R)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(4-morpholinophenyl)propanamide CAS Name: (2R)-N-[4-(4-morpholinyl)phenyl]-2-(4-pentan-3-yl-1-pyridin-1-iumyl)propanamide IUPAC Name: (2R)-N-(4-morpholin-4-ylphenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)propanamide Traditional Name: (2R)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(4-morpholinophenyl)propionamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=[N+](C=C1)C(C)C(=O)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)[C@H](C)C(=O)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C23H31N3O2/c1-4-19(5-2)20-10-12-25(13-11-20)18(3)23(27)24-21-6-8-22(9-7-21)26-14-16-28-17-15-26/h6-13,18-19H,4-5,14-17H2,1-3H3/p+1/t18-/m1/s1