N-[1-Ethyl-2-(4-nitrophenoxy)butyl]-N-methyl-3,4,5-trimethoxybenzeneethanamine

HCID 20031390
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Basic information

Standard SMILES
CCC(Oc1ccc([N+](=O)[O-])cc1)C(CC)N(C)CCc1cc(OC)c(OC)c(OC)c1
InChIKey
VTTZUIJZJQBTNA-UHFFFAOYSA-N
Molecular formula
C24H34N2O6
Average molar mass
446.5 g/mol

Names & identifiers

Preferred name
N-[1-Ethyl-2-(4-nitrophenoxy)butyl]-N-methyl-3,4,5-trimethoxybenzeneethanamine
IUPAC
N-methyl-4-(4-nitrophenoxy)-N-[2-(3,4,5-trimethoxyphenyl)ethyl]hexan-3-amine

Names & synonyms

SCHEMBL10509188VTTZUIJZJQBTNA-UHFFFAOYSA-NN-[1-Ethyl-2-(4-nitrophenoxy)butyl]-N-methyl-3,4,5-trimethoxybenzeneethanamine

Database identifiers

PubChem CID
20031390

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
86 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
12
Heavy atoms
32

Related reactions

2 records
New reaction record

Compound notes

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