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

Systemtic Name: ethyl 4-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[3-(4-chlorophenyl)isoxazol-5-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-(4-chlorophenyl)-5-isoxazolyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[3-(4-chlorophenyl)isoxazol-5-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H20ClN3O3 MolecularWeight: 349.812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=CC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=CC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H20ClN3O3/c1-2-23-17(22)21-9-7-20(8-10-21)12-15-11-16(19-24-15)13-3-5-14(18)6-4-13/h3-6,11H,2,7-10,12H2,1H3