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

Systemtic Name: N-(4-morpholin-4-ylphenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(4-morpholinophenyl)acetamide CAS Name: N-[4-(4-morpholinyl)phenyl]-2-(4-pentan-3-yl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)acetamide Traditional Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(4-morpholinophenyl)acetamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O2/c1-3-18(4-2)19-9-11-24(12-10-19)17-22(26)23-20-5-7-21(8-6-20)25-13-15-27-16-14-25/h5-12,18H,3-4,13-17H2,1-2H3/p+1