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78C

Summary
Name:CYCLOPENTYL 2-OXO-4-PHENYLAZETIDINE-1-CARBOXYLATE
Formula:C15 H17 N O3
Formal charge:0
Formula weight:259.3 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01cyclopentyl (4S)-2-oxo-4-phenylazetidine-1-carboxylate
OpenEye OEToolkits1.9.2cyclopentyl (4S)-2-oxidanylidene-4-phenyl-azetidine-1-carboxylate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(OC1CCCC1)N3C(=O)CC3c2ccccc2
InChIInChI1.03InChI=1S/C15H17NO3/c17-14-10-13(11-6-2-1-3-7-11)16(14)15(18)19-12-8-4-5-9-12/h1-3,6-7,12-13H,4-5,8-10H2/t13-/m0/s1
InChIKeyInChI1.03HXGULOODWVYRBT-ZDUSSCGKSA-N
SMILES_CANONICALCACTVS3.385O=C1C[C@H](N1C(=O)OC2CCCC2)c3ccccc3
SMILESCACTVS3.385O=C1C[CH](N1C(=O)OC2CCCC2)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits1.9.2c1ccc(cc1)[C@@H]2CC(=O)N2C(=O)OC3CCCC3
SMILESOpenEye OEToolkits1.9.2c1ccc(cc1)C2CC(=O)N2C(=O)OC3CCCC3

223532

건을2024-08-07부터공개중

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