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YJ5

Summary
Name:4-[(N-butylpentanamido)methyl]-N-hydroxybenzamide
Formula:C17 H26 N2 O3
Formal charge:0
Formula weight:306.4 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-[(N-butylpentanamido)methyl]-N-hydroxybenzamide
OpenEye OEToolkits2.0.74-[[butyl(pentanoyl)amino]methyl]-~{N}-oxidanyl-benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01CCCCC(=O)N(CCCC)Cc1ccc(cc1)C(=O)NO
InChIInChI1.06InChI=1S/C17H26N2O3/c1-3-5-7-16(20)19(12-6-4-2)13-14-8-10-15(11-9-14)17(21)18-22/h8-11,22H,3-7,12-13H2,1-2H3,(H,18,21)
InChIKeyInChI1.06RUZXVBRXLWFADZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)CCCC
SMILESCACTVS3.385CCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)CCCC
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCCC(=O)N(CCCC)Cc1ccc(cc1)C(=O)NO
SMILESOpenEye OEToolkits2.0.7CCCCC(=O)N(CCCC)Cc1ccc(cc1)C(=O)NO

221051

PDB entries from 2024-06-12

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