Compound Identification
SMILES
CC1(C)C[N+](CCCCCCS)(c2ccccc12)C1=Cc2cc(ccc2O[C@@]11Cc2ccccc2N1)[N+]([O-])=O
InChIKey
InChIKey=NNSAWYBVWXRNKE-GYXLRUHFSA-O
Formula
C32H36N3O3S
Mass
542.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
- Subclass 1-benzopyrans
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Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
1-benzopyrans
Alternative Parents
Indolines Nitroaromatic compounds Aralkylamines Benzenoids Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Alkylthiols Organooxygen compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzopyran - Indole or derivatives - Dihydroindole - Nitroaromatic compound - Aralkylamine - Benzenoid - C-nitro compound - Organic nitro compound - Alkylthiol - Organic oxoazanium - Oxacycle - Azacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Organic oxide - Organic oxygen compound - Organic salt - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
External Descriptors
Not available