[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate Openeye Name: [3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methyl 5-amino-3-methyl-isoxazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isoxazolecarboxylic acid [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 5-amino-3-methyl-1,2-oxazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isoxazole-4-carboxylic acid (3-p-cumenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)C(C)C)N

Isomeric SMILES

CC1=NOC(=C1C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)C(C)C)N

InChI

InChI=1S/C17H18N4O4/c1-9(2)11-4-6-12(7-5-11)16-19-13(24-21-16)8-23-17(22)14-10(3)20-25-15(14)18/h4-7,9H,8,18H2,1-3H3