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

Systemtic Name: (2R)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)-N-(4-phenoxyphenyl)propanamide Openeye Name: (2R)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(4-phenoxyphenyl)propanamide CAS Name: (2R)-2-(4-pentan-3-yl-1-pyridin-1-iumyl)-N-(4-phenoxyphenyl)propanamide IUPAC Name: (2R)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)-N-(4-phenoxyphenyl)propanamide Traditional Name: (2R)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(4-phenoxyphenyl)propionamide Formula: C25H29N2O2+ MolecularWeight: 389.50996

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)OC3=CC=CC=C3

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)[C@H](C)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O2/c1-4-20(5-2)21-15-17-27(18-16-21)19(3)25(28)26-22-11-13-24(14-12-22)29-23-9-7-6-8-10-23/h6-20H,4-5H2,1-3H3/p+1/t19-/m1/s1