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

Systemtic Name: (2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-phenoxyphenyl)propanamide Openeye Name: (2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-phenoxyphenyl)propanamide CAS Name: (2R)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]-N-(4-phenoxyphenyl)propanamide IUPAC Name: (2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-phenoxyphenyl)propanamide Traditional Name: (2R)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(4-phenoxyphenyl)propionamide Formula: C22H24N3O2+ MolecularWeight: 362.44486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)[N+]3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)[N+]3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H23N3O2/c1-17(25-15-13-19(14-16-25)24(2)3)22(26)23-18-9-11-21(12-10-18)27-20-7-5-4-6-8-20/h4-17H,1-3H3/p+1/t17-/m1/s1