(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-[(2-bromophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-[(2-bromophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 2-[(2-bromobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-bromophenyl)-oxomethyl]amino]-3-methylbutanoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-[(2-bromobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-bromobenzoyl)amino]-3-methyl-butyric acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C18H21BrN2O4 MolecularWeight: 409.27434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C18H21BrN2O4/c1-10(2)16(20-17(22)13-7-5-6-8-15(13)19)18(23)24-9-14-11(3)21-25-12(14)4/h5-8,10,16H,9H2,1-4H3,(H,20,22)