1-[(2R)-1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[(2R)-1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[(1R)-2-(4-bromoanilino)-1-methyl-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[(2R)-1-(4-bromoanilino)-1-oxopropan-2-yl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[(2R)-1-(4-bromoanilino)-1-oxopropan-2-yl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[(1R)-2-(4-bromoanilino)-2-keto-1-methyl-ethyl]pyridin-1-ium-3-carboxamide Formula: C15H15BrN3O2+ MolecularWeight: 349.2025

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14BrN3O2/c1-10(19-8-2-3-11(9-19)14(17)20)15(21)18-13-6-4-12(16)5-7-13/h2-10H,1H3,(H2-,17,18,20,21)/p+1/t10-/m1/s1