(2S)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-ethylphenyl)propanamide

Systemtic Name: (2S)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-ethylphenyl)propanamide Openeye Name: (2S)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-ethylphenyl)propanamide CAS Name: (2S)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]-N-(4-ethylphenyl)propanamide IUPAC Name: (2S)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-ethylphenyl)propanamide Traditional Name: (2S)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-ethylphenyl)propionamide Formula: C18H24N3O+ MolecularWeight: 298.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)[N+]2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)[N+]2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C18H23N3O/c1-5-15-6-8-16(9-7-15)19-18(22)14(2)21-12-10-17(11-13-21)20(3)4/h6-14H,5H2,1-4H3/p+1/t14-/m0/s1