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4-Propyl-2-o-tolyl-oxazole-5-carboxylic acid 2,5-dioxo-pyrrolidin-1-yl ester

HCID 59301429
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCCc1nc(-c2ccccc2C)oc1C(=O)ON1C(=O)CCC1=O
InChIKey
GOILPLFMEUBNKY-UHFFFAOYSA-N
Molecular formula
C18H18N2O5
Average molar mass
342.3 g/mol

Names & identifiers

Preferred name
4-Propyl-2-o-tolyl-oxazole-5-carboxylic acid 2,5-dioxo-pyrrolidin-1-yl ester
IUPAC
(2,5-dioxopyrrolidin-1-yl) 2-(2-methylphenyl)-4-propyl-1,3-oxazole-5-carboxylate

Names & synonyms

SCHEMBL2792499GOILPLFMEUBNKY-UHFFFAOYSA-N4-propyl-2-o-tolyl-oxazole-5-carboxylic acid 2,5-dioxo-pyrrolidin-1-yl ester

Database identifiers

PubChem CID
59301429

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
89.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
25
Formal charge
0
Complexity
522

Related reactions

2 records
New reaction record
HRID 196372 reaction equation
HRID 196372As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 2236292 reaction equation
HRID 2236292As reactantuspto-grants-2010_05

Compound notes

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