3-[[(E)-2-[(4-bromophenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]propanoic acid

Systemtic Name: 3-[[(E)-2-[(4-bromophenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]propanoic acid Openeye Name: 3-[[(E)-2-[(4-bromobenzoyl)amino]-3-phenyl-prop-2-enoyl]amino]propanoic acid CAS Name: 3-[[(E)-2-[[(4-bromophenyl)-oxomethyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(E)-2-[(4-bromobenzoyl)amino]-3-phenylprop-2-enoyl]amino]propanoic acid Traditional Name: 3-[[(E)-2-[(4-bromobenzoyl)amino]-3-phenyl-acryloyl]amino]propionic acid Formula: C19H17BrN2O4 MolecularWeight: 417.25328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C(=O)NCCC(=O)O)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)/C=C(\C(=O)NCCC(=O)O)/NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H17BrN2O4/c20-15-8-6-14(7-9-15)18(25)22-16(12-13-4-2-1-3-5-13)19(26)21-11-10-17(23)24/h1-9,12H,10-11H2,(H,21,26)(H,22,25)(H,23,24)/b16-12+