(2R)-2-[(2-bromanyl-5-methoxy-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[(2-bromanyl-5-methoxy-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[(2-bromo-5-methoxy-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(2-bromo-5-methoxyphenyl)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[(2-bromo-5-methoxybenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(2-bromo-5-methoxy-benzoyl)amino]-4-(methylthio)butyrate Formula: C13H15BrNO4S- MolecularWeight: 361.2315

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)N[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C13H16BrNO4S/c1-19-8-3-4-10(14)9(7-8)12(16)15-11(13(17)18)5-6-20-2/h3-4,7,11H,5-6H2,1-2H3,(H,15,16)(H,17,18)/p-1/t11-/m1/s1