(E)-2-methoxy-3-nitro-5-((2,4,6-trimethoxystyrylsulfinyl)methyl)pyridine

HCID 56598657
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Basic information

Standard SMILES
COc1cc(OC)c(/C=C/S(=O)Cc2cnc(OC)c([N+](=O)[O-])c2)c(OC)c1
InChIKey
VPLWPDLJHUSYOA-AATRIKPKSA-N
Molecular formula
C18H20N2O7S
Average molar mass
408.4 g/mol

Names & identifiers

Preferred name
(E)-2-methoxy-3-nitro-5-((2,4,6-trimethoxystyrylsulfinyl)methyl)pyridine
IUPAC
2-methoxy-3-nitro-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfinylmethyl]pyridine

Names & synonyms

SCHEMBL15123732VPLWPDLJHUSYOA-AATRIKPKSA-N(E)-2-methoxy-3-nitro-5-((2,4,6-trimethoxystyrylsulfinyl)methyl)pyridine

Database identifiers

PubChem CID
56598657

Properties

Computed structural properties

XLogP
2
Topological polar surface area
132 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
8
Heavy atoms
28

Related reactions

1 records
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Compound notes

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