methyl 5-(butan-2-ylamino)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate

Systemtic Name: methyl 5-(butan-2-ylamino)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate Openeye Name: methyl 3-(4-chlorophenyl)-5-(sec-butylamino)isoxazole-4-carboxylate CAS Name: 5-(butan-2-ylamino)-3-(4-chlorophenyl)-4-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(butan-2-ylamino)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-5-(sec-butylamino)isoxazole-4-carboxylic acid methyl ester Formula: C15H17ClN2O3 MolecularWeight: 308.76008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=NO1)C2=CC=C(C=C2)Cl)C(=O)OC

Isomeric SMILES

CCC(C)NC1=C(C(=NO1)C2=CC=C(C=C2)Cl)C(=O)OC

InChI

InChI=1S/C15H17ClN2O3/c1-4-9(2)17-14-12(15(19)20-3)13(18-21-14)10-5-7-11(16)8-6-10/h5-9,17H,4H2,1-3H3