1-[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-(3-chloro-4-cyanoanilino)-2-oxoethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-(3-chloro-4-cyanoanilino)-2-oxoethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-(3-chloro-4-cyano-anilino)-2-keto-ethyl]pyridin-1-ium-3-carboxamide Formula: C15H12ClN4O2+ MolecularWeight: 315.73438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC(=O)NC2=CC(=C(C=C2)C#N)Cl)C(=O)N

Isomeric SMILES

C1=CC(=C[N+](=C1)CC(=O)NC2=CC(=C(C=C2)C#N)Cl)C(=O)N

InChI

InChI=1S/C15H11ClN4O2/c16-13-6-12(4-3-10(13)7-17)19-14(21)9-20-5-1-2-11(8-20)15(18)22/h1-6,8H,9H2,(H2-,18,19,21,22)/p+1