(2S)-2-[2-(2-oxidanylidene-1,3-dihydroindol-3-yl)ethanoylamino]pentanedioic acid

Systemtic Name: (2S)-2-[2-(2-oxidanylidene-1,3-dihydroindol-3-yl)ethanoylamino]pentanedioic acid Openeye Name: (2S)-2-[[2-(2-oxoindolin-3-yl)acetyl]amino]pentanedioic acid CAS Name: (2S)-2-[[1-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]amino]pentanedioic acid IUPAC Name: (2S)-2-[[2-(2-oxo-1,3-dihydroindol-3-yl)acetyl]amino]pentanedioic acid Traditional Name: (2S)-2-[[2-(2-ketoindolin-3-yl)acetyl]amino]glutaric acid Formula: C15H16N2O6 MolecularWeight: 321.290749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(=O)N2)CC(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C(=O)N2)CC(=O)[15NH][C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C15H16N2O6/c18-12(16-11(15(22)23)5-6-13(19)20)7-9-8-3-1-2-4-10(8)17-14(9)21/h1-4,9,11H,5-7H2,(H,16,18)(H,17,21)(H,19,20)(H,22,23)/t9?,11-/m0/s1/i16+1