ethyl 4,6-dicyano-1H-indole-2-carboxylate

HCID 89995321
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Basic information

Standard SMILES
CCOC(=O)c1cc2c(C#N)cc(C#N)cc2[nH]1
InChIKey
QIGMOXZGOZDGLW-UHFFFAOYSA-N
Molecular formula
C13H9N3O2
Average molar mass
239.23 g/mol

Names & identifiers

Preferred name
ethyl 4,6-dicyano-1H-indole-2-carboxylate
IUPAC
ethyl 4,6-dicyano-1H-indole-2-carboxylate

Names & synonyms

SCHEMBL15506641QIGMOXZGOZDGLW-UHFFFAOYSA-Nethyl 4,6-dicyano-1H-indole-2-carboxylate

Database identifiers

PubChem CID
89995321

Properties

Computed structural properties

XLogP
2
Topological polar surface area
89.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
18

Related reactions

2 records
New reaction record

Compound notes

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