[(1S,2R)-2-(dibutylcarbamoyl)-2-phenylcyclopropyl]methylazanium2-hydroxy-2-oxoacetate

[(1S,2R)-2-(dibutylcarbamoyl)-2-phenylcyclopropyl]methylazanium;2-hydroxy-2-oxoacetate

CAS: 105310-43-8

Molecular Formula	`C21H32N2O5`
Molecular Weight	392.5 g/mol
Topological Polar Surface Area	125.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	9
Exact Mass	392.2311
Heavy Atoms	28
Complexity	421.0

Chemical Identifiers

CAS Number	105310-43-8
SMILES	`CCCCN(CCCC)C(=O)C1(CC1C[NH3+])C2=CC=CC=C2.C(=O)(C(=O)[O-])O`
InChIKey	`KSKVOYHVTYRAHL-ZFNKBKEPSA-N`

📖 Product Overview

[(1S,2R)-2-(dibutylcarbamoyl)-2-phenylcyclopropyl]methylazanium2-hydroxy-2-oxoacetate (CAS: 105310-43-8) is a chemical compound with molecular formula C21H32N2O5 and molecular weight 392.5 g/mol. Its IUPAC systematic name is [(1S,2R)-2-(dibutylcarbamoyl)-2-phenylcyclopropyl]methylazanium;2-hydroxy-2-oxoacetate. Topological Polar Surface Area 125.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 9 Exact Mass 392.2311 Heavy Atoms 28 Complexity 421.0 InChI Key: KSKVOYHVTYRAHL-ZFNKBKEPSA-N. SMILES: CCCCN(CCCC)C(=O)C1(CC1C[NH3+])C2=CC=CC=C2.C(=O)(C(=O)[O-])O.

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