(2S)-2-(1H-indol-3-ylmethyl)-2-oxidanyl-4-oxidanylidene-pentanedioic acid

Systemtic Name: (2S)-2-(1H-indol-3-ylmethyl)-2-oxidanyl-4-oxidanylidene-pentanedioic acid Openeye Name: (2S)-2-hydroxy-2-(1H-indol-3-ylmethyl)-4-oxo-pentanedioic acid CAS Name: (2S)-2-hydroxy-2-(1H-indol-3-ylmethyl)-4-oxopentanedioic acid IUPAC Name: (2S)-2-hydroxy-2-(1H-indol-3-ylmethyl)-4-oxopentanedioic acid Traditional Name: (2S)-2-hydroxy-2-(1H-indol-3-ylmethyl)-4-keto-glutaric acid Formula: C14H13NO6 MolecularWeight: 291.25612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(CC(=O)C(=O)O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@](CC(=O)C(=O)O)(C(=O)O)O

InChI

InChI=1S/C14H13NO6/c16-11(12(17)18)6-14(21,13(19)20)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,15,21H,5-6H2,(H,17,18)(H,19,20)/t14-/m0/s1