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A1B2E

Summary
Name:(3S)-1-[(1,2-benzoxazol-3-yl)methyl]-6-oxopiperidine-3-carboxamide
Formula:C14 H15 N3 O3
Formal charge:0
Formula weight:273.287 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52(3S)-1-[(1,2-benzoxazol-3-yl)methyl]-6-oxopiperidine-3-carboxamide
OpenEye OEToolkits3.1.0.0(3~{S})-1-(1,2-benzoxazol-3-ylmethyl)-6-oxidanylidene-piperidine-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52NC(=O)C1CCC(=O)N(C1)Cc1noc2ccccc21
InChIInChI1.06InChI=1S/C14H15N3O3/c15-14(19)9-5-6-13(18)17(7-9)8-11-10-3-1-2-4-12(10)20-16-11/h1-4,9H,5-8H2,(H2,15,19)/t9-/m0/s1
InChIKeyInChI1.06HVDPIVYFHACNKQ-VIFPVBQESA-N
SMILES_CANONICALCACTVS3.385NC(=O)[C@H]1CCC(=O)N(C1)Cc2noc3ccccc23
SMILESCACTVS3.385NC(=O)[CH]1CCC(=O)N(C1)Cc2noc3ccccc23
SMILES_CANONICALOpenEye OEToolkits3.1.0.0c1ccc2c(c1)c(no2)CN3C[C@H](CCC3=O)C(=O)N
SMILESOpenEye OEToolkits3.1.0.0c1ccc2c(c1)c(no2)CN3CC(CCC3=O)C(=O)N

248636

PDB entries from 2026-02-04

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