(2S)-1-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: (2S)-1-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]-2,3-dihydroindole-2-carboxylic acid Openeye Name: (2S)-1-[(E)-4-hydroxy-4-oxo-but-2-enoyl]indoline-2-carboxylic acid CAS Name: (2S)-1-[(E)-4-hydroxy-1,4-dioxobut-2-enyl]-2,3-dihydroindole-2-carboxylic acid IUPAC Name: (2S)-1-[(E)-4-hydroxy-4-oxobut-2-enoyl]-2,3-dihydroindole-2-carboxylic acid Traditional Name: (2S)-1-[(E)-4-hydroxy-4-keto-but-2-enoyl]indoline-2-carboxylic acid Formula: C13H11NO5 MolecularWeight: 261.23014

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C21)C(=O)C=CC(=O)O)C(=O)O

Isomeric SMILES

C1[C@H](N(C2=CC=CC=C21)C(=O)/C=C/C(=O)O)C(=O)O

InChI

InChI=1S/C13H11NO5/c15-11(5-6-12(16)17)14-9-4-2-1-3-8(9)7-10(14)13(18)19/h1-6,10H,7H2,(H,16,17)(H,18,19)/b6-5+/t10-/m0/s1