4-(2-Ethoxy-3,4-dioxo-cyclobut-1-enylamino)-3-ethylbenzonitrile

HCID 19972918

Basic information

Standard SMILES
CCOc1c(Nc2ccc(C#N)cc2CC)c(=O)c1=O
InChIKey
OGJHZARZOMVMJD-UHFFFAOYSA-N
Molecular formula
C15H14N2O3
Average molar mass
270.28 g/mol

Names & identifiers

Preferred name
4-(2-Ethoxy-3,4-dioxo-cyclobut-1-enylamino)-3-ethylbenzonitrile
IUPAC
4-[(2-ethoxy-3,4-dioxocyclobuten-1-yl)amino]-3-ethylbenzonitrile

Names & synonyms

SCHEMBL4407734OGJHZARZOMVMJD-UHFFFAOYSA-N4-(2-ethoxy-3,4-dioxo-cyclobut-1-enylamino)-3-ethylbenzonitrile4-(3,4-Dioxo-2-ethoxy-cyclobut-1-enylamino)-3-ethyl-benzonitrile4-(3,4-dioxo-2-ethoxy-cyclobut-1-enylamino)-3-ethylbenzonitrile

Database identifiers

PubChem CID
19972918

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
79.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
20

Related reactions

4 records

Compound notes

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