ethyl 1-[1-[(5-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-[(5-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(5-chloro-2-methyl-anilino)-1-methyl-2-oxo-ethyl]piperidine-4-carboxylate CAS Name: 1-[1-(5-chloro-2-methylanilino)-1-oxopropan-2-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(5-chloro-2-methylanilino)-1-oxopropan-2-yl]piperidine-4-carboxylate Traditional Name: 1-[2-(5-chloro-2-methyl-anilino)-2-keto-1-methyl-ethyl]isonipecotic acid ethyl ester Formula: C18H25ClN2O3 MolecularWeight: 352.8557

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(C)C(=O)NC2=C(C=CC(=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(C)C(=O)NC2=C(C=CC(=C2)Cl)C

InChI

InChI=1S/C18H25ClN2O3/c1-4-24-18(23)14-7-9-21(10-8-14)13(3)17(22)20-16-11-15(19)6-5-12(16)2/h5-6,11,13-14H,4,7-10H2,1-3H3,(H,20,22)