2,3-Dihydro-4-hydroxy-2-oxo-1H-indole-3-acetic acid; (R)-form, Nitrile 

AlkaPlorer ID: AK295828

Synonym: 2,3-Dihydro-4-hydroxy-2-oxo-1H-indole-3-acetonitrile, 4-Hydroxyoxindole-3-acetonitrile 

IUPAC Name: 2-(4-hydroxy-2-oxo-1,3-dihydroindol-3-yl)acetonitrile

Structure

SMILES: N#CCC1C(=O)NC2=C1C(O)=CC=C2

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InChI: InChI=1S/C10H8N2O2/c11-5-4-6-9-7(12-10(6)14)2-1-3-8(9)13/h1-3,6,13H,4H2,(H,12,14)

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InChIKey: KJLUDHCNWCIINR-UHFFFAOYSA-N

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Reference

PubChem CID: 5316720

CAS: 1380540-77-1

NPASS: NPC158702

COCONUT: CNP0171248.3

Properties Information

Molecule Weight: 188.186

TPSA: 73.12

MolLogP: 1.3415799999999998

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information