3-(3-Dimethylcarbamoyl-4-nitrophenyl)propionic acid ethyl ester

HCID 66675868
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)CCc1ccc([N+](=O)[O-])c(C(=O)N(C)C)c1
InChIKey
UFHIHSKWONKTBC-UHFFFAOYSA-N
Molecular formula
C14H18N2O5
Average molar mass
294.3 g/mol

Names & identifiers

Preferred name
3-(3-Dimethylcarbamoyl-4-nitrophenyl)propionic acid ethyl ester
IUPAC
ethyl 3-[3-(dimethylcarbamoyl)-4-nitrophenyl]propanoate

Names & synonyms

SCHEMBL397878UFHIHSKWONKTBC-UHFFFAOYSA-N3-(3-Dimethylcarbamoyl-4-nitrophenyl)propionic acid ethyl ester3- (3-Dimethylcarbamoyl-4-nitrophenyl)propionic acid ethyl ester

Database identifiers

PubChem CID
66675868

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
92.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
21

Related reactions

4 records
New reaction record

Linked notes

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