Compound Identification
SMILES
CC1(C)\C(=C\C=C\C2=[N+](CC3=CC=C(CC(O)=O)C=C3)C3=CC=CC=C3O2)N(CC2=CC(=CC(=C2)[N+]([O-])=O)[N+]([O-])=O)C2=C1C=C(C=C2)S([O-])(=O)=O
InChIKey
InChIKey=KQBJAMHRYMZJIV-UHFFFAOYSA-N
Formula
C36H30N4O10S
Mass
710.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazoles
Alternative Parents
1-sulfo,2-unsubstituted aromatic compounds Indoles and derivatives Nitrobenzenes Tertiary alkylarylamines Phenylmethylamines Benzylamines Nitroaromatic compounds Aralkylamines Sulfonyls Oxazoles Heteroaromatic compounds Organosulfonic acids Amino acids Azacyclic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Enamines Carboxylic acids Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organic oxides Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-sulfo,2-unsubstituted aromatic compound - Nitrobenzene - Indole or derivatives - Benzoxazole - Arylsulfonic acid or derivatives - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Benzylamine - Phenylmethylamine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Sulfonyl - Azole - Organic sulfonic acid or derivatives - Organosulfonic acid - Organosulfonic acid or derivatives - Oxazole - Organic nitro compound - Amino acid - Tertiary amine - Amino acid or derivatives - C-nitro compound - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Enamine - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Amine - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazoles. These are organic compounds containing a benzene fused to an oxazole ring Oxazole is five-membered aromatic ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively.
External Descriptors
Not available