(E)-2-cyano-3-(4-dimethylaminophenyl)-N-(2-pyridin-1-ium-1-ylethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-dimethylaminophenyl)-N-(2-pyridin-1-ium-1-ylethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-dimethylaminophenyl)-N-(2-pyridin-1-ium-1-ylethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-dimethylaminophenyl)-N-[2-(1-pyridin-1-iumyl)ethyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-dimethylaminophenyl)-N-(2-pyridin-1-ium-1-ylethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-dimethylaminophenyl)-N-(2-pyridin-1-ium-1-ylethyl)acrylamide Formula: C19H21N4O+ MolecularWeight: 321.39624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NCC[N+]2=CC=CC=C2

InChI

InChI=1S/C19H20N4O/c1-22(2)18-8-6-16(7-9-18)14-17(15-20)19(24)21-10-13-23-11-4-3-5-12-23/h3-9,11-12,14H,10,13H2,1-2H3/p+1/b17-14+