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A1H3Y

Summary
Name:2-(5-phenylmethoxy-1~{H}-indol-3-yl)ethanol
Formula:C17 H17 N O2
Formal charge:0
Formula weight:267.322 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.72-(5-phenylmethoxy-1~{H}-indol-3-yl)ethanol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C17H17NO2/c19-9-8-14-11-18-17-7-6-15(10-16(14)17)20-12-13-4-2-1-3-5-13/h1-7,10-11,18-19H,8-9,12H2
InChIKeyInChI1.06SQAUQUOZCKVQND-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OCCc1c[nH]c2ccc(OCc3ccccc3)cc12
SMILESCACTVS3.385OCCc1c[nH]c2ccc(OCc3ccccc3)cc12
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)COc2ccc3c(c2)c(c[nH]3)CCO
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)COc2ccc3c(c2)c(c[nH]3)CCO

250059

PDB entries from 2026-03-04

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