2-[(4-bromanyl-2-methyl-phenyl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[(4-bromo-2-methyl-benzoyl)amino]-3-hydroxy-butanoic acid CAS Name: 2-[[(4-bromo-2-methylphenyl)-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[(4-bromo-2-methylbenzoyl)amino]-3-hydroxybutanoic acid Traditional Name: 2-[(4-bromo-2-methyl-benzoyl)amino]-3-hydroxy-butyric acid Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)C(=O)NC(C(C)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)C(=O)NC(C(C)O)C(=O)O

InChI

InChI=1S/C12H14BrNO4/c1-6-5-8(13)3-4-9(6)11(16)14-10(7(2)15)12(17)18/h3-5,7,10,15H,1-2H3,(H,14,16)(H,17,18)