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

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl (2S)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (5-methylisoxazol-3-yl)methyl (2S)-2-[(4-bromobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-bromophenyl)-oxomethyl]amino]-3-methylbutanoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl (2S)-2-[(4-bromobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-bromobenzoyl)amino]-3-methyl-butyric acid (5-methylisoxazol-3-yl)methyl ester Formula: C17H19BrN2O4 MolecularWeight: 395.24776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=NO1)COC(=O)[C@H](C(C)C)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H19BrN2O4/c1-10(2)15(17(22)23-9-14-8-11(3)24-20-14)19-16(21)12-4-6-13(18)7-5-12/h4-8,10,15H,9H2,1-3H3,(H,19,21)/t15-/m0/s1