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A1BRV

Summary
Name:(3S)-1-[(2,3-dihydro-1-benzofuran-7-yl)methyl]-5-oxopyrrolidine-3-carboxamide
Formula:C14 H16 N2 O3
Formal charge:0
Formula weight:260.288 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52(3S)-1-[(2,3-dihydro-1-benzofuran-7-yl)methyl]-5-oxopyrrolidine-3-carboxamide
OpenEye OEToolkits3.1.0.0(3~{S})-1-(2,3-dihydro-1-benzofuran-7-ylmethyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52NC(=O)C1CC(=O)N(C1)Cc1cccc2CCOc12
InChIInChI1.06InChI=1S/C14H16N2O3/c15-14(18)11-6-12(17)16(8-11)7-10-3-1-2-9-4-5-19-13(9)10/h1-3,11H,4-8H2,(H2,15,18)/t11-/m0/s1
InChIKeyInChI1.06GEUCKEBNKVUUPC-NSHDSACASA-N
SMILES_CANONICALCACTVS3.385NC(=O)[C@@H]1CN(Cc2cccc3CCOc23)C(=O)C1
SMILESCACTVS3.385NC(=O)[CH]1CN(Cc2cccc3CCOc23)C(=O)C1
SMILES_CANONICALOpenEye OEToolkits3.1.0.0c1cc2c(c(c1)CN3C[C@H](CC3=O)C(=O)N)OCC2
SMILESOpenEye OEToolkits3.1.0.0c1cc2c(c(c1)CN3CC(CC3=O)C(=O)N)OCC2

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PDB entries from 2026-02-04

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