Structure Information
Structure

Compound Identification

SMILES

[Na+].CCC1=C2Oc3c(ccc(NCCNc4nc(Cl)nc(Nc5ccc(cc5S(O)(=O)=O)S(O)(=O)=O)n4)c3S(O)(=O)=O)N=C2C(Cl)=C2Oc3c(ccc(NCCNc4nc(Cl)nc(Nc5ccc(cc5S(O)(=O)=O)S(O)(=O)=O)n4)c3S([O-])(=O)=O)N=C12

InChIKey

InChIKey=KKJSAIDKPWEHHY-UHFFFAOYSA-M

Formula

C42H34Cl3N14NaO20S6

Mass

1376.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxazines

Subclass

Phenoxazines

Intermediate Tree Nodes

Not available

Direct Parent

Phenoxazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenoxazine - Diaryl ether - Benzenesulfonate - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - 2,4-diamine-s-triazine - Aniline or substituted anilines - Chloro-s-triazine - Halo-s-triazine - N-aliphatic s-triazine - Secondary aliphatic/aromatic amine - Aminotriazine - Amino-1,3,5-triazine - 1,3,5-triazine - Benzenoid - Triazine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic metal halide - Oxacycle - Azacycle - Organic alkali metal salt - Secondary amine - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenoxazines. These are polycyclic aromatic compounds containing a phenoxazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a 1,4-oxazine ring.

External Descriptors

Not available

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