Ethyl 3-amino-2-(4-chlorophenylcarbamoyl)crotonate

HCID 70610046
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Basic information

Standard SMILES
CCOC(=O)/C(C(=O)Nc1ccc(Cl)cc1)=C(/C)N
InChIKey
XSEPXWGNSUCZDS-FLIBITNWSA-N
Molecular formula
C13H15ClN2O3
Average molar mass
282.72 g/mol

Names & identifiers

Preferred name
Ethyl 3-amino-2-(4-chlorophenylcarbamoyl)crotonate
IUPAC
ethyl (Z)-3-amino-2-[(4-chlorophenyl)carbamoyl]but-2-enoate

Names & synonyms

SCHEMBL11560418XSEPXWGNSUCZDS-FLIBITNWSA-Nethyl 3-amino-2-(4-chlorophenylcarbamoyl)crotonate

Database identifiers

PubChem CID
70610046

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
81.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
19

Related reactions

3 records
New reaction record

Compound notes

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