ethyl 1-[4-[(5-chloranylpyridin-2-yl)amino]-4-oxidanylidene-butanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-[(5-chloranylpyridin-2-yl)amino]-4-oxidanylidene-butanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-[(5-chloro-2-pyridyl)amino]-4-oxo-butanoyl]piperidine-4-carboxylate CAS Name: 1-[4-[(5-chloro-2-pyridinyl)amino]-1,4-dioxobutyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(5-chloropyridin-2-yl)amino]-4-oxobutanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[(5-chloro-2-pyridyl)amino]-4-keto-butanoyl]isonipecotic acid ethyl ester Formula: C17H22ClN3O4 MolecularWeight: 367.82728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C17H22ClN3O4/c1-2-25-17(24)12-7-9-21(10-8-12)16(23)6-5-15(22)20-14-4-3-13(18)11-19-14/h3-4,11-12H,2,5-10H2,1H3,(H,19,20,22)