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

Systemtic Name: methyl 3-(4-chlorophenyl)-5-[4-(phenylmethyl)piperidin-1-yl]-1,2-oxazole-4-carboxylate Openeye Name: methyl 5-(4-benzyl-1-piperidyl)-3-(4-chlorophenyl)isoxazole-4-carboxylate CAS Name: 3-(4-chlorophenyl)-5-[4-(phenylmethyl)-1-piperidinyl]-4-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-benzylpiperidin-1-yl)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate Traditional Name: 5-(4-benzylpiperidino)-3-(4-chlorophenyl)isoxazole-4-carboxylic acid methyl ester Formula: C23H23ClN2O3 MolecularWeight: 410.89332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(ON=C1C2=CC=C(C=C2)Cl)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(ON=C1C2=CC=C(C=C2)Cl)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H23ClN2O3/c1-28-23(27)20-21(18-7-9-19(24)10-8-18)25-29-22(20)26-13-11-17(12-14-26)15-16-5-3-2-4-6-16/h2-10,17H,11-15H2,1H3