6-[[(Z)-2-[(5-bromanylfuran-2-yl)carbonylamino]-3-(4-bromophenyl)prop-2-enoyl]amino]hexanoate

Systemtic Name: 6-[[(Z)-2-[(5-bromanylfuran-2-yl)carbonylamino]-3-(4-bromophenyl)prop-2-enoyl]amino]hexanoate Openeye Name: 6-[[(Z)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]hexanoate CAS Name: 6-[[(Z)-2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]hexanoate IUPAC Name: 6-[[(Z)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]hexanoate Traditional Name: 6-[[(Z)-2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino]hexanoate Formula: C20H19Br2N2O5- MolecularWeight: 527.18326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C(=O)NCCCCCC(=O)[O-])NC(=O)C2=CC=C(O2)Br)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H20Br2N2O5/c21-14-7-5-13(6-8-14)12-15(24-20(28)16-9-10-17(22)29-16)19(27)23-11-3-1-2-4-18(25)26/h5-10,12H,1-4,11H2,(H,23,27)(H,24,28)(H,25,26)/p-1/b15-12-