(2S)-2-[(3-bromophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[(3-bromophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[(3-bromobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(3-bromophenyl)-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[(3-bromobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(3-bromobenzoyl)amino]-3-methyl-butyrate Formula: C12H13BrNO3- MolecularWeight: 299.14052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO3/c1-7(2)10(12(16)17)14-11(15)8-4-3-5-9(13)6-8/h3-7,10H,1-2H3,(H,14,15)(H,16,17)/p-1/t10-/m0/s1