methyl 2-[[(3-bromophenyl)carbonyl-cyclohexyl-amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[(3-bromophenyl)carbonyl-cyclohexyl-amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[(3-bromobenzoyl)-cyclohexyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(3-bromophenyl)-oxomethyl]-cyclohexylamino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-bromobenzoyl)-cyclohexylamino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[(3-bromobenzoyl)-cyclohexyl-amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C19H21BrN2O4 MolecularWeight: 421.28504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=COC(=N1)CN(C2CCCCC2)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

COC(=O)C1=COC(=N1)CN(C2CCCCC2)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H21BrN2O4/c1-25-19(24)16-12-26-17(21-16)11-22(15-8-3-2-4-9-15)18(23)13-6-5-7-14(20)10-13/h5-7,10,12,15H,2-4,8-9,11H2,1H3