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2-Benzoyl-N-(5,5-dimethyl-2-oxooxolan-3-yl)benzene-1-carboximidic acid

HCID 53724
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Basic information

CAS
77694-44-1
Standard SMILES
CC1(C)CC(NC(=O)c2ccccc2C(=O)c2ccccc2)C(=O)O1
InChIKey
GHBZAYMQAWPNQV-UHFFFAOYSA-N
Molecular formula
C20H19NO4
Average molar mass
337.4 g/mol
Monoisotopic mass
337.13140809

Names & identifiers

Preferred name
2-Benzoyl-N-(5,5-dimethyl-2-oxooxolan-3-yl)benzene-1-carboximidic acid
IUPAC
2-benzoyl-N-(5,5-dimethyl-2-oxooxolan-3-yl)benzamide

Names & synonyms

77694-44-1DTXSID909989072-Benzoyl-N-(5,5-dimethyl-2-oxooxolan-3-yl)benzene-1-carboximidic acidRefChem:1062380DTXCID901425888BRN 5590658o-Benzoyl-N-(5,5-dimethyl-2-oxotetrahydro-3-furyl)benzamideBENZAMIDE, o-BENZOYL-N-(5,5-DIMETHYL-2-OXOTETRAHYDRO-3-FURYL)-

Database identifiers

CAS
77694-44-1
PubChem CID
53724
DTXSID
DTXSID90998907
Nikkaji
J149.022B

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
72.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
25
Formal charge
0
Complexity
536

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Compound notes

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