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Q2X

Summary
Name:4-chloranyl-~{N}3-phenyl-~{N}1-(phenylmethyl)benzene-1,3-dicarboxamide
Formula:C21 H17 Cl N2 O2
Formal charge:0
Formula weight:364.825 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits3.1.0.04-chloranyl-~{N}3-phenyl-~{N}1-(phenylmethyl)benzene-1,3-dicarboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C21H17ClN2O2/c22-19-12-11-16(20(25)23-14-15-7-3-1-4-8-15)13-18(19)21(26)24-17-9-5-2-6-10-17/h1-13H,14H2,(H,23,25)(H,24,26)
InChIKeyInChI1.06FGJAFYUJIBFJCH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Clc1ccc(cc1C(=O)Nc2ccccc2)C(=O)NCc3ccccc3
SMILESCACTVS3.385Clc1ccc(cc1C(=O)Nc2ccccc2)C(=O)NCc3ccccc3
SMILES_CANONICALOpenEye OEToolkits3.1.0.0c1ccc(cc1)CNC(=O)c2ccc(c(c2)C(=O)Nc3ccccc3)Cl
SMILESOpenEye OEToolkits3.1.0.0c1ccc(cc1)CNC(=O)c2ccc(c(c2)C(=O)Nc3ccccc3)Cl

222415

數據於2024-07-10公開中

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