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

Systemtic Name: 1-[(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[(1R)-2-(4-cyanoanilino)-1-methyl-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[(1R)-2-(4-cyanoanilino)-2-keto-1-methyl-ethyl]pyridin-1-ium-3-carboxamide Formula: C16H15N4O2+ MolecularWeight: 295.3159

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O2/c1-11(20-8-2-3-13(10-20)15(18)21)16(22)19-14-6-4-12(9-17)5-7-14/h2-8,10-11H,1H3,(H2-,18,19,21,22)/p+1/t11-/m1/s1