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NBI

Summary
Name:2-nitro-N-phenylbenzamide
Formula:C13 H10 N2 O3
Formal charge:0
Formula weight:242.23 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.6.12-nitro-N-phenyl-benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILES_CANONICALCACTVS3.352[O-][N+](=O)c1ccccc1C(=O)Nc2ccccc2
SMILESCACTVS3.352[O-][N+](=O)c1ccccc1C(=O)Nc2ccccc2
SMILES_CANONICALOpenEye OEToolkits1.7.0c1ccc(cc1)NC(=O)c2ccccc2[N+](=O)[O-]
SMILESOpenEye OEToolkits1.7.0c1ccc(cc1)NC(=O)c2ccccc2[N+](=O)[O-]
InChIInChI1.03InChI=1S/C13H10N2O3/c16-13(14-10-6-2-1-3-7-10)11-8-4-5-9-12(11)15(17)18/h1-9H,(H,14,16)
InChIKeyInChI1.03RNFCQIOHQPIUOI-UHFFFAOYSA-N

223532

数据于2024-08-07公开中

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