(4-bromophenyl)methyl 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: (4-bromophenyl)methyl 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate Openeye Name: (4-bromophenyl)methyl 5-amino-3-methyl-isoxazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isoxazolecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 5-amino-3-methyl-1,2-oxazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isoxazole-4-carboxylic acid (4-bromobenzyl) ester Formula: C12H11BrN2O3 MolecularWeight: 311.13134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OCC2=CC=C(C=C2)Br)N

Isomeric SMILES

CC1=NOC(=C1C(=O)OCC2=CC=C(C=C2)Br)N

InChI

InChI=1S/C12H11BrN2O3/c1-7-10(11(14)18-15-7)12(16)17-6-8-2-4-9(13)5-3-8/h2-5H,6,14H2,1H3