4-oxidanyl-3-(4-oxidanyl-4-oxidanylidene-butyl)-1H-indole-2,5-dicarboxylic acid

Systemtic Name: 4-oxidanyl-3-(4-oxidanyl-4-oxidanylidene-butyl)-1H-indole-2,5-dicarboxylic acid Openeye Name: 4-hydroxy-3-(4-hydroxy-4-oxo-butyl)-1H-indole-2,5-dicarboxylic acid CAS Name: 4-hydroxy-3-(4-hydroxy-4-oxobutyl)-1H-indole-2,5-dicarboxylic acid IUPAC Name: 4-hydroxy-3-(4-hydroxy-4-oxobutyl)-1H-indole-2,5-dicarboxylic acid Traditional Name: 4-hydroxy-3-(4-hydroxy-4-keto-butyl)-1H-indole-2,5-dicarboxylic acid Formula: C14H13NO7 MolecularWeight: 307.25552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(N2)C(=O)O)CCCC(=O)O)C(=C1C(=O)O)O

Isomeric SMILES

C1=CC2=C(C(=C(N2)C(=O)O)CCCC(=O)O)C(=C1C(=O)O)O

InChI

InChI=1S/C14H13NO7/c16-9(17)3-1-2-6-10-8(15-11(6)14(21)22)5-4-7(12(10)18)13(19)20/h4-5,15,18H,1-3H2,(H,16,17)(H,19,20)(H,21,22)