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0MO

Summary
Name:(4R)-4-(3-butoxy-4-methoxybenzyl)imidazolidin-2-one
Synonyms:4-(3-butoxy-4-methoxyphenyl)methyl-2-imidazolidone
Formula:C15 H22 N2 O3
Formal charge:0
Formula weight:278.347 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs11.02(4R)-4-(3-butoxy-4-methoxybenzyl)imidazolidin-2-one
OpenEye OEToolkits1.6.1(4R)-4-[(3-butoxy-4-methoxy-phenyl)methyl]imidazolidin-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs11.02O=C1NCC(N1)Cc2cc(OCCCC)c(OC)cc2
SMILES_CANONICALCACTVS3.352CCCCOc1cc(C[C@@H]2CNC(=O)N2)ccc1OC
SMILESCACTVS3.352CCCCOc1cc(C[CH]2CNC(=O)N2)ccc1OC
SMILES_CANONICALOpenEye OEToolkits1.7.0CCCCOc1cc(ccc1OC)C[C@@H]2CNC(=O)N2
SMILESOpenEye OEToolkits1.7.0CCCCOc1cc(ccc1OC)CC2CNC(=O)N2
InChIInChI1.03InChI=1S/C15H22N2O3/c1-3-4-7-20-14-9-11(5-6-13(14)19-2)8-12-10-16-15(18)17-12/h5-6,9,12H,3-4,7-8,10H2,1-2H3,(H2,16,17,18)/t12-/m1/s1
InChIKeyInChI1.03PDMUULPVBYQBBK-GFCCVEGCSA-N

222415

PDB entries from 2024-07-10

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