2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-[(2R)-4-phenylbutan-2-yl]ethanamide

Systemtic Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-[(2R)-4-phenylbutan-2-yl]ethanamide Openeye Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide CAS Name: 2-[4-(dimethylamino)-1-pyridin-1-iumyl]-N-[(2R)-4-phenylbutan-2-yl]acetamide IUPAC Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-[(2R)-4-phenylbutan-2-yl]acetamide Traditional Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide Formula: C19H26N3O+ MolecularWeight: 312.42924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O/c1-16(9-10-17-7-5-4-6-8-17)20-19(23)15-22-13-11-18(12-14-22)21(2)3/h4-8,11-14,16H,9-10,15H2,1-3H3/p+1/t16-/m1/s1