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

Systemtic Name: ethyl 1-[1-[(3-chloranyl-4-methoxy-phenyl)amino]-1-oxidanylidene-propan-2-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(3-chloro-4-methoxy-anilino)-1-methyl-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]piperidine-3-carboxylate Traditional Name: 1-[2-(3-chloro-4-methoxy-anilino)-2-keto-1-methyl-ethyl]nipecotic acid ethyl ester Formula: C18H25ClN2O4 MolecularWeight: 368.8551

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClN2O4/c1-4-25-18(23)13-6-5-9-21(11-13)12(2)17(22)20-14-7-8-16(24-3)15(19)10-14/h7-8,10,12-13H,4-6,9,11H2,1-3H3,(H,20,22)