(E)-4-oxidanyl-2-oxidanylidene-4-(5-oxidanyl-1H-indol-3-yl)but-3-enoic acid

Systemtic Name: (E)-4-oxidanyl-2-oxidanylidene-4-(5-oxidanyl-1H-indol-3-yl)but-3-enoic acid Openeye Name: (E)-4-hydroxy-4-(5-hydroxy-1H-indol-3-yl)-2-oxo-but-3-enoic acid CAS Name: (E)-4-hydroxy-4-(5-hydroxy-1H-indol-3-yl)-2-oxo-3-butenoic acid IUPAC Name: (E)-4-hydroxy-4-(5-hydroxy-1H-indol-3-yl)-2-oxobut-3-enoic acid Traditional Name: (E)-4-hydroxy-4-(5-hydroxy-1H-indol-3-yl)-2-keto-but-3-enoic acid Formula: C12H9NO5 MolecularWeight: 247.20356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)C(=CC(=O)C(=O)O)O

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C12H9NO5/c14-6-1-2-9-7(3-6)8(5-13-9)10(15)4-11(16)12(17)18/h1-5,13-15H,(H,17,18)/b10-4+