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E2F

Summary
Name:2-chloranyl-10-(2-piperidin-4-ylethyl)phenoxazine
Formula:C19 H21 Cl N2 O
Formal charge:0
Formula weight:328.836 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.72-chloranyl-10-(2-piperidin-4-ylethyl)phenoxazine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C19H21ClN2O/c20-15-5-6-19-17(13-15)22(12-9-14-7-10-21-11-8-14)16-3-1-2-4-18(16)23-19/h1-6,13-14,21H,7-12H2
InChIKeyInChI1.03FAAYNSPZJRWJJC-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Clc1ccc2Oc3ccccc3N(CCC4CCNCC4)c2c1
SMILESCACTVS3.385Clc1ccc2Oc3ccccc3N(CCC4CCNCC4)c2c1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc2c(c1)N(c3cc(ccc3O2)Cl)CCC4CCNCC4
SMILESOpenEye OEToolkits2.0.7c1ccc2c(c1)N(c3cc(ccc3O2)Cl)CCC4CCNCC4

218500

数据于2024-04-17公开中

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