5-bromanyl-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C=CC(=O)NC2=C(C=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1=COC(=C1)/C=C/C(=O)NC2=C(C=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C14H10BrNO4/c15-9-3-5-12(11(8-9)14(18)19)16-13(17)6-4-10-2-1-7-20-10/h1-8H,(H,16,17)(H,18,19)/b6-4+