5-bromanyl-2-[2-[2-[(2S)-butan-2-yl]phenoxy]ethanoylamino]benzoate

Systemtic Name: 5-bromanyl-2-[2-[2-[(2S)-butan-2-yl]phenoxy]ethanoylamino]benzoate Openeye Name: 5-bromo-2-[[2-[2-[(1S)-1-methylpropyl]phenoxy]acetyl]amino]benzoate CAS Name: 5-bromo-2-[[2-[2-[(2S)-butan-2-yl]phenoxy]-1-oxoethyl]amino]benzoate IUPAC Name: 5-bromo-2-[[2-[2-[(2S)-butan-2-yl]phenoxy]acetyl]amino]benzoate Traditional Name: 5-bromo-2-[[2-[2-[(1S)-1-methylpropyl]phenoxy]acetyl]amino]benzoate Formula: C19H19BrNO4- MolecularWeight: 405.26246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC(=O)NC2=C(C=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCC(=O)NC2=C(C=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C19H20BrNO4/c1-3-12(2)14-6-4-5-7-17(14)25-11-18(22)21-16-9-8-13(20)10-15(16)19(23)24/h4-10,12H,3,11H2,1-2H3,(H,21,22)(H,23,24)/p-1/t12-/m0/s1