Compound Identification
SMILES
C=CCNC1=NC(=NC(NCC=C)=N1)N1CCC(CC1)OC(=O)C1=CC2=C(OOC=C2)C=C1
InChIKey
InChIKey=PFEOAVMGMARTTN-UHFFFAOYSA-N
Formula
C23H26N6O4
Mass
450.499
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodioxins
- Subclass Benzo-o-dioxins
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Class
Benzodioxins
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxins
Subclass
Benzo-o-dioxins
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-o-dioxins
Alternative Parents
Dialkylarylamines Secondary alkylarylamines N-aliphatic s-triazines Piperidines Ortho dioxins Benzenoids 1,3,5-triazines Heteroaromatic compounds Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-o-dioxin - Dialkylarylamine - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - Secondary aliphatic/aromatic amine - Ortho-dioxin - 1,3,5-triazine - Benzenoid - Triazine - Piperidine - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Carboxylic acid derivative - Oxacycle - Azacycle - Secondary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-o-dioxins. These are organic compounds containing a benzene ring fused to a 1,2-dioxin ring.
External Descriptors
Not available