methyl 3-(4-chlorophenyl)-5-[4-(4-ethanoylphenyl)piperazin-1-yl]-1,2-oxazole-4-carboxylate

Systemtic Name: methyl 3-(4-chlorophenyl)-5-[4-(4-ethanoylphenyl)piperazin-1-yl]-1,2-oxazole-4-carboxylate Openeye Name: methyl 5-[4-(4-acetylphenyl)piperazin-1-yl]-3-(4-chlorophenyl)isoxazole-4-carboxylate CAS Name: 5-[4-(4-acetylphenyl)-1-piperazinyl]-3-(4-chlorophenyl)-4-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-(4-acetylphenyl)piperazin-1-yl]-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate Traditional Name: 5-[4-(4-acetylphenyl)piperazino]-3-(4-chlorophenyl)isoxazole-4-carboxylic acid methyl ester Formula: C23H22ClN3O4 MolecularWeight: 439.89148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NO3)C4=CC=C(C=C4)Cl)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NO3)C4=CC=C(C=C4)Cl)C(=O)OC

InChI

InChI=1S/C23H22ClN3O4/c1-15(28)16-5-9-19(10-6-16)26-11-13-27(14-12-26)22-20(23(29)30-2)21(25-31-22)17-3-7-18(24)8-4-17/h3-10H,11-14H2,1-2H3