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LO9

Summary
Name:7-[(3,5-dimethoxyphenyl)methyl]pyrrolo[3,4-g][1,2]benzoxazole
Formula:C18 H16 N2 O3
Formal charge:0
Formula weight:308.331 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.77-[(3,5-dimethoxyphenyl)methyl]pyrrolo[3,4-g][1,2]benzoxazole

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C18H16N2O3/c1-21-15-5-12(6-16(7-15)22-2)9-20-10-14-4-3-13-8-19-23-18(13)17(14)11-20/h3-8,10-11H,9H2,1-2H3
InChIKeyInChI1.06GVTUEXALHVXNOH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1cc(Cn2cc3ccc4cnoc4c3c2)cc(OC)c1
SMILESCACTVS3.385COc1cc(Cn2cc3ccc4cnoc4c3c2)cc(OC)c1
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1cc(cc(c1)OC)Cn2cc3ccc4cnoc4c3c2
SMILESOpenEye OEToolkits2.0.7COc1cc(cc(c1)OC)Cn2cc3ccc4cnoc4c3c2

223532

PDB entries from 2024-08-07

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