4-[[(E)-3-(5-bromanylfuran-2-yl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-[[(E)-3-(5-bromanylfuran-2-yl)prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(E)-3-(5-bromo-2-furyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[(E)-3-(5-bromo-2-furanyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(E)-3-(5-bromofuran-2-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(E)-3-(5-bromo-2-furyl)acryloyl]amino]benzoic acid Formula: C14H10BrNO4 MolecularWeight: 336.1375

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)C=CC2=CC=C(O2)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)/C=C/C2=CC=C(O2)Br

InChI

InChI=1S/C14H10BrNO4/c15-12-7-5-11(20-12)6-8-13(17)16-10-3-1-9(2-4-10)14(18)19/h1-8H,(H,16,17)(H,18,19)/b8-6+