(2-azanyl-2-oxidanylidene-ethyl) (2S)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) (2S)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (2-amino-2-oxo-ethyl) (2S)-2-[(4-bromobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-bromophenyl)-oxomethyl]amino]-3-methylbutanoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) (2S)-2-[(4-bromobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-bromobenzoyl)amino]-3-methyl-butyric acid (2-amino-2-keto-ethyl) ester Formula: C14H17BrN2O4 MolecularWeight: 357.19978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N)NC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)N)NC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C14H17BrN2O4/c1-8(2)12(14(20)21-7-11(16)18)17-13(19)9-3-5-10(15)6-4-9/h3-6,8,12H,7H2,1-2H3,(H2,16,18)(H,17,19)/t12-/m0/s1