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9AC

Summary
Name:9-ACRIDINECARBONYL
Synonyms:9-ACRIDINOYL
Formula:C14 H9 N O2
Formal charge:0
Formula weight:223.227 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04acridine-9-carbaldehyde
OpenEye OEToolkits2.0.7acridine-9-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=Cc1c3c(nc2c1cccc2)cccc3
InChIInChI1.06InChI=1S/C14H9NO2/c16-14(17)13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H,16,17)
InChIKeyInChI1.06IYRYQBAAHMBIFT-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC(=O)c1c2ccccc2nc3ccccc13
SMILESCACTVS3.385OC(=O)c1c2ccccc2nc3ccccc13
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc2c(c1)c(c3ccccc3n2)C(=O)O
SMILESOpenEye OEToolkits2.0.7c1ccc2c(c1)c(c3ccccc3n2)C(=O)O

225946

PDB entries from 2024-10-09

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