Chemical Component Summary

Name(2S)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid
Synonyms(S)-carprofen
Identifiers(2S)-2-(6-chloranyl-9H-carbazol-2-yl)propanoic acid
FormulaC15 H12 Cl N O2
Molecular Weight273.714
TypeNON-POLYMER
Isomeric SMILESC[C@@H](c1ccc2c3cc(ccc3[nH]c2c1)Cl)C(=O)O
InChIInChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)/t8-/m0/s1
InChIKeyPUXBGTOOZJQSKH-QMMMGPOBSA-N

Chemical Details

Formal Charge0
Atom Count31
Chiral Atom Count1
Bond Count33
Aromatic Bond Count15

Related Resource References

Resource NameReference
PubChem 667685
ChEMBL CHEMBL2171249
ChEBI CHEBI:59207
CCDC/CSD UQOBIM02, UQOBIM, UQOBIM01, UQOBIM03, FAKRAM, FAKQUF01