ethyl 4-[[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethanoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethanoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(5-chloro-2-cyano-anilino)-2-oxo-acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-(5-chloro-2-cyanoanilino)-1,2-dioxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-chloro-2-cyanoanilino)-2-oxoacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(5-chloro-2-cyano-anilino)-2-keto-acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C17H19ClN4O4 MolecularWeight: 378.81016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C(=O)NC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C(=O)NC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C17H19ClN4O4/c1-2-26-17(25)22-7-5-13(6-8-22)20-15(23)16(24)21-14-9-12(18)4-3-11(14)10-19/h3-4,9,13H,2,5-8H2,1H3,(H,20,23)(H,21,24)