4-[3-[(4-bromanylfuran-2-yl)carbonylamino]phenoxy]phthalic acid

Systemtic Name: 4-[3-[(4-bromanylfuran-2-yl)carbonylamino]phenoxy]phthalic acid Openeye Name: 4-[3-[(4-bromofuran-2-carbonyl)amino]phenoxy]phthalic acid CAS Name: 4-[3-[[(4-bromo-2-furanyl)-oxomethyl]amino]phenoxy]phthalic acid IUPAC Name: 4-[3-[(4-bromofuran-2-carbonyl)amino]phenoxy]phthalic acid Traditional Name: 4-[3-[(4-bromo-2-furoyl)amino]phenoxy]phthalic acid Formula: C19H12BrNO7 MolecularWeight: 446.20508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O)NC(=O)C3=CC(=CO3)Br

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O)NC(=O)C3=CC(=CO3)Br

InChI

InChI=1S/C19H12BrNO7/c20-10-6-16(27-9-10)17(22)21-11-2-1-3-12(7-11)28-13-4-5-14(18(23)24)15(8-13)19(25)26/h1-9H,(H,21,22)(H,23,24)(H,25,26)