2-(4-pentan-3-ylpyridin-1-ium-1-yl)-N-[(2R)-4-phenylbutan-2-yl]ethanamide

Systemtic Name: 2-(4-pentan-3-ylpyridin-1-ium-1-yl)-N-[(2R)-4-phenylbutan-2-yl]ethanamide Openeye Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide CAS Name: 2-(4-pentan-3-yl-1-pyridin-1-iumyl)-N-[(2R)-4-phenylbutan-2-yl]acetamide IUPAC Name: 2-(4-pentan-3-ylpyridin-1-ium-1-yl)-N-[(2R)-4-phenylbutan-2-yl]acetamide Traditional Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC(C)CCC2=CC=CC=C2

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)CC(=O)N[C@H](C)CCC2=CC=CC=C2

InChI

InChI=1S/C22H30N2O/c1-4-20(5-2)21-13-15-24(16-14-21)17-22(25)23-18(3)11-12-19-9-7-6-8-10-19/h6-10,13-16,18,20H,4-5,11-12,17H2,1-3H3/p+1/t18-/m1/s1