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

Systemtic Name: ethyl 4-azanyl-5-(4-bromophenyl)carbonyl-1,2-oxazole-3-carboxylate Openeye Name: ethyl 4-amino-5-(4-bromobenzoyl)isoxazole-3-carboxylate CAS Name: 4-amino-5-[(4-bromophenyl)-oxomethyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-(4-bromobenzoyl)-1,2-oxazole-3-carboxylate Traditional Name: 4-amino-5-(4-bromobenzoyl)isoxazole-3-carboxylic acid ethyl ester Formula: C13H11BrN2O4 MolecularWeight: 339.14144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1N)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1=NOC(=C1N)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H11BrN2O4/c1-2-19-13(18)10-9(15)12(20-16-10)11(17)7-3-5-8(14)6-4-7/h3-6H,2,15H2,1H3