(2S)-2-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-1-oxoethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[(5-bromo-2-furoyl)amino]acetyl]amino]-3-phenyl-propionate Formula: C16H14BrN2O5- MolecularWeight: 394.19676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)CNC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC(=O)CNC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C16H15BrN2O5/c17-13-7-6-12(24-13)15(21)18-9-14(20)19-11(16(22)23)8-10-4-2-1-3-5-10/h1-7,11H,8-9H2,(H,18,21)(H,19,20)(H,22,23)/p-1/t11-/m0/s1