3-[[(Z)-3-(4-bromophenyl)-2-(furan-2-ylcarbonylamino)prop-2-enoyl]amino]propanoic acid

Systemtic Name: 3-[[(Z)-3-(4-bromophenyl)-2-(furan-2-ylcarbonylamino)prop-2-enoyl]amino]propanoic acid Openeye Name: 3-[[(Z)-3-(4-bromophenyl)-2-(furan-2-carbonylamino)prop-2-enoyl]amino]propanoic acid CAS Name: 3-[[(Z)-3-(4-bromophenyl)-2-[[2-furanyl(oxo)methyl]amino]-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(Z)-3-(4-bromophenyl)-2-(furan-2-carbonylamino)prop-2-enoyl]amino]propanoic acid Traditional Name: 3-[[(Z)-3-(4-bromophenyl)-2-(2-furoylamino)acryloyl]amino]propionic acid Formula: C17H15BrN2O5 MolecularWeight: 407.2154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)NCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN2O5/c18-12-5-3-11(4-6-12)10-13(16(23)19-8-7-15(21)22)20-17(24)14-2-1-9-25-14/h1-6,9-10H,7-8H2,(H,19,23)(H,20,24)(H,21,22)/b13-10-