(2R)-2-[[(E)-2-[(5-bromanylfuran-2-yl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]-3-methyl-butanoate

Systemtic Name: (2R)-2-[[(E)-2-[(5-bromanylfuran-2-yl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]-3-methyl-butanoate Openeye Name: (2R)-2-[[(E)-2-[(5-bromofuran-2-carbonyl)amino]-3-phenyl-prop-2-enoyl]amino]-3-methyl-butanoate CAS Name: (2R)-2-[[(E)-2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]-3-methylbutanoate IUPAC Name: (2R)-2-[[(E)-2-[(5-bromofuran-2-carbonyl)amino]-3-phenylprop-2-enoyl]amino]-3-methylbutanoate Traditional Name: (2R)-2-[[(E)-2-[(5-bromo-2-furoyl)amino]-3-phenyl-acryloyl]amino]-3-methyl-butyrate Formula: C19H18BrN2O5- MolecularWeight: 434.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C(=CC1=CC=CC=C1)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN2O5/c1-11(2)16(19(25)26)22-17(23)13(10-12-6-4-3-5-7-12)21-18(24)14-8-9-15(20)27-14/h3-11,16H,1-2H3,(H,21,24)(H,22,23)(H,25,26)/p-1/b13-10+/t16-/m1/s1