Structure Information
Structure

Compound Identification

SMILES

OCCNC1=NC(F)=NC(NC2=CC3=C(C=C2)C(=O)\C(=N/NC2=CC=CC=C2S(O)(=O)=O)C(=C3)S(O)(=O)=O)=N1

InChIKey

InChIKey=IJBASXPPKOZXHM-RHANQZHGSA-N

Formula

C21H18FN7O8S2

Mass

579.53

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Naphthalenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Naphthalene - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Phenylhydrazine - 2,4-diamine-s-triazine - Aryl ketone - Aminotriazine - Secondary aliphatic/aromatic amine - N-aliphatic s-triazine - Halo-s-triazine - Amino-1,3,5-triazine - 1,3,5-triazine - Monocyclic benzene moiety - Triazine - Aryl halide - Aryl fluoride - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Ketone - Alkanolamine - Azacycle - Organoheterocyclic compound - Hydrazone - Secondary amine - Primary alcohol - Organic oxygen compound - Organic nitrogen compound - Amine - Alcohol - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.

External Descriptors

Not available

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