methyl 3-bromanyl-4-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-bromanyl-4-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-bromo-4-[2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethoxy]benzoate CAS Name: 3-bromo-4-[2-[[(2S)-butan-2-yl]amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[2-[[(2S)-butan-2-yl]amino]-2-oxoethoxy]benzoate Traditional Name: 3-bromo-4-[2-keto-2-[[(1S)-1-methylpropyl]amino]ethoxy]benzoic acid methyl ester Formula: C14H18BrNO4 MolecularWeight: 344.20102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC1=C(C=C(C=C1)C(=O)OC)Br

Isomeric SMILES

CC[C@H](C)NC(=O)COC1=C(C=C(C=C1)C(=O)OC)Br

InChI

InChI=1S/C14H18BrNO4/c1-4-9(2)16-13(17)8-20-12-6-5-10(7-11(12)15)14(18)19-3/h5-7,9H,4,8H2,1-3H3,(H,16,17)/t9-/m0/s1