ethyl 4-[[(2S)-2-bromanyl-3-methyl-butanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(2S)-2-bromanyl-3-methyl-butanoyl]amino]benzoate Openeye Name: ethyl 4-[[(2S)-2-bromo-3-methyl-butanoyl]amino]benzoate CAS Name: 4-[[(2S)-2-bromo-3-methyl-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2S)-2-bromo-3-methylbutanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-bromo-3-methyl-butanoyl]amino]benzoic acid ethyl ester Formula: C14H18BrNO3 MolecularWeight: 328.20162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrNO3/c1-4-19-14(18)10-5-7-11(8-6-10)16-13(17)12(15)9(2)3/h5-9,12H,4H2,1-3H3,(H,16,17)/t12-/m0/s1