ethyl 1-[1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(4-chloro-2-methoxy-5-methyl-anilino)-1-methyl-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[1-(4-chloro-2-methoxy-5-methylanilino)-1-oxopropan-2-yl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-chloro-2-methoxy-5-methylanilino)-1-oxopropan-2-yl]piperidine-3-carboxylate Traditional Name: 1-[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-keto-1-methyl-ethyl]nipecotic acid ethyl ester Formula: C19H27ClN2O4 MolecularWeight: 382.88168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(C)C(=O)NC2=C(C=C(C(=C2)C)Cl)OC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(C)C(=O)NC2=C(C=C(C(=C2)C)Cl)OC

InChI

InChI=1S/C19H27ClN2O4/c1-5-26-19(24)14-7-6-8-22(11-14)13(3)18(23)21-16-9-12(2)15(20)10-17(16)25-4/h9-10,13-14H,5-8,11H2,1-4H3,(H,21,23)