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

Systemtic Name: 1-[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(3-chloro-4-cyanoanilino)-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(3-chloro-4-cyanoanilino)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(3-chloro-4-cyano-anilino)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C15H18ClN4O2+ MolecularWeight: 321.78202

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C15H17ClN4O2/c16-13-7-12(2-1-11(13)8-17)19-14(21)9-20-5-3-10(4-6-20)15(18)22/h1-2,7,10H,3-6,9H2,(H2,18,22)(H,19,21)/p+1