Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=C2CCCC3C(N(N=C23)C2=NC(=C(S2)C2=CC=CC=C2)C2=CC=CC=C2)C2=CC=C(C=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=KWZIWLGOHYQDPM-UHFFFAOYSA-N
Formula
C35H27N5O4S
Mass
613.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Linear diarylheptanoids
Alternative Parents
Nitrobenzenes Nitroaromatic compounds 2,4,5-trisubstituted thiazoles Pyrazolines Heteroaromatic compounds N-alkylated hydrazones Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Nitrobenzene - 2,4,5-trisubstituted 1,3-thiazole - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Pyrazoline - Thiazole - Organic nitro compound - C-nitro compound - N-alkylated hydrazone - Azacycle - Organoheterocyclic compound - Hydrazone - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available