4-(5-bromanylfuran-2-yl)-1,4-dihydropyridine-2,3,5,6-tetracarboxylic acid

Systemtic Name: 4-(5-bromanylfuran-2-yl)-1,4-dihydropyridine-2,3,5,6-tetracarboxylic acid Openeye Name: 4-(5-bromo-2-furyl)-1,4-dihydropyridine-2,3,5,6-tetracarboxylic acid CAS Name: 4-(5-bromo-2-furanyl)-1,4-dihydropyridine-2,3,5,6-tetracarboxylic acid IUPAC Name: 4-(5-bromofuran-2-yl)-1,4-dihydropyridine-2,3,5,6-tetracarboxylic acid Traditional Name: 4-(5-bromo-2-furyl)-1,4-dihydropyridine-2,3,5,6-tetracarboxylic acid Formula: C13H8BrNO9 MolecularWeight: 402.10792

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)Br)C2C(=C(NC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=C(OC(=C1)Br)C2C(=C(NC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C13H8BrNO9/c14-4-2-1-3(24-4)5-6(10(16)17)8(12(20)21)15-9(13(22)23)7(5)11(18)19/h1-2,5,15H,(H,16,17)(H,18,19)(H,20,21)(H,22,23)