Ethyl 2-methyl-4-(3-nitrophenyl)-6-phenyl-3-pyridinecarboxylate

HCID 10248079
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Basic information

Standard SMILES
CCOC(=O)c1c(-c2cccc([N+](=O)[O-])c2)cc(-c2ccccc2)nc1C
InChIKey
MLILNHXYWQBMMS-UHFFFAOYSA-N
Molecular formula
C21H18N2O4
Average molar mass
362.4 g/mol
Monoisotopic mass
362.12665706

Names & identifiers

Preferred name
Ethyl 2-methyl-4-(3-nitrophenyl)-6-phenyl-3-pyridinecarboxylate
IUPAC
ethyl 2-methyl-4-(3-nitrophenyl)-6-phenylpyridine-3-carboxylate

Names & synonyms

SCHEMBL9872964MLILNHXYWQBMMS-UHFFFAOYSA-Nethyl 2-methyl-4-(3-nitrophenyl)-6-phenyl-3-pyridinecarboxylate

Database identifiers

PubChem CID
10248079

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
85 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
27

Related reactions

19 records
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Compound notes

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