(2R)-N-(4-acetamidophenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(4-acetamidophenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(4-acetamidophenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(4-acetamidophenyl)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]propanamide IUPAC Name: (2R)-N-(4-acetamidophenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(4-acetamidophenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]propionamide Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)[N+]2=CC=C(C=C2)N(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)NC(=O)C)[N+]2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C18H22N4O2/c1-13(22-11-9-17(10-12-22)21(3)4)18(24)20-16-7-5-15(6-8-16)19-14(2)23/h5-13H,1-4H3,(H-,19,20,23,24)/p+1/t13-/m1/s1