ethyl 4-[(2-chlorophenyl)methyl]-1-[(5-methyl-1,2-oxazol-3-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(2-chlorophenyl)methyl]-1-[(5-methyl-1,2-oxazol-3-yl)carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 4-[(2-chlorophenyl)methyl]-1-(5-methylisoxazole-3-carbonyl)piperidine-4-carboxylate CAS Name: 4-[(2-chlorophenyl)methyl]-1-[(5-methyl-3-isoxazolyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-chlorophenyl)methyl]-1-(5-methyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxylate Traditional Name: 4-(2-chlorobenzyl)-1-(5-methylisoxazole-3-carbonyl)isonipecotic acid ethyl ester Formula: C20H23ClN2O4 MolecularWeight: 390.86062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=NOC(=C2)C)CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=NOC(=C2)C)CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H23ClN2O4/c1-3-26-19(25)20(13-15-6-4-5-7-16(15)21)8-10-23(11-9-20)18(24)17-12-14(2)27-22-17/h4-7,12H,3,8-11,13H2,1-2H3