Methyl 4,5-Methylenedioxy-2-(3-methyl-4-nitrobenzoyl)phenylacetate

HCID 53912114
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)Cc1cc2c(cc1C(=O)c1ccc([N+](=O)[O-])c(C)c1)OCO2
InChIKey
IEMQDQVIQIMCLA-UHFFFAOYSA-N
Molecular formula
C18H15NO7
Average molar mass
357.3 g/mol

Names & identifiers

Preferred name
Methyl 4,5-Methylenedioxy-2-(3-methyl-4-nitrobenzoyl)phenylacetate
IUPAC
methyl 2-[6-(3-methyl-4-nitrobenzoyl)-1,3-benzodioxol-5-yl]acetate

Names & synonyms

SCHEMBL6625108IEMQDQVIQIMCLA-UHFFFAOYSA-NMethyl 4,5-Methylenedioxy-2-(3-methyl-4-nitrobenzoyl)phenylacetate

Database identifiers

PubChem CID
53912114

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
108 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
26

Related reactions

3 records
New reaction record

Linked notes

Loading…