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Ethyl 3-chloro-4-(1-indolinylcarbonylamino)phenylacetate

HCID 17859294
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)Cc1ccc(NC(=O)N2CCc3ccccc32)c(Cl)c1
InChIKey
OPLXWMJSHPNJJC-UHFFFAOYSA-N
Molecular formula
C19H19ClN2O3
Average molar mass
358.8 g/mol
Monoisotopic mass
358.1084202

Names & identifiers

Preferred name
Ethyl 3-chloro-4-(1-indolinylcarbonylamino)phenylacetate
IUPAC
ethyl 2-[3-chloro-4-(2,3-dihydroindole-1-carbonylamino)phenyl]acetate

Names & synonyms

SCHEMBL2430296OPLXWMJSHPNJJC-UHFFFAOYSA-Nethyl 3-chloro-4-(1-indolinylcarbonylamino)phenylacetate

Database identifiers

PubChem CID
17859294

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
58.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Formal charge
0
Complexity
487

Related reactions

4 records
New reaction record
HRID 117590 reaction equation
HRID 117590As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 303757 reaction equation
HRID 303757As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1372631 reaction equation
HRID 1372631As productuspto-grants-2007_01
HRID 1372632 reaction equation
HRID 1372632As reactantuspto-grants-2007_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes