2-cyano-3-(2,4-dichlorophenyl)-N-(pyridin-1-ium-3-ylmethyl)prop-2-enamide

Systemtic Name: 2-cyano-3-(2,4-dichlorophenyl)-N-(pyridin-1-ium-3-ylmethyl)prop-2-enamide Openeye Name: 2-cyano-3-(2,4-dichlorophenyl)-N-(pyridin-1-ium-3-ylmethyl)prop-2-enamide CAS Name: 2-cyano-3-(2,4-dichlorophenyl)-N-(3-pyridin-1-iumylmethyl)-2-propenamide IUPAC Name: 2-cyano-3-(2,4-dichlorophenyl)-N-(pyridin-1-ium-3-ylmethyl)prop-2-enamide Traditional Name: 2-cyano-3-(2,4-dichlorophenyl)-N-(pyridin-1-ium-3-ylmethyl)acrylamide Formula: C16H12Cl2N3O+ MolecularWeight: 333.19198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[NH+]=C1)CNC(=O)C(=CC2=C(C=C(C=C2)Cl)Cl)C#N

Isomeric SMILES

C1=CC(=C[NH+]=C1)CNC(=O)C(=CC2=C(C=C(C=C2)Cl)Cl)C#N

InChI

InChI=1S/C16H11Cl2N3O/c17-14-4-3-12(15(18)7-14)6-13(8-19)16(22)21-10-11-2-1-5-20-9-11/h1-7,9H,10H2,(H,21,22)/p+1