Structure Information
Structure

Compound Identification

SMILES

[O-]S(=O)(=O)C(F)(F)F.CN1CC23C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%14=C%10C8=C8C%10=C%15C%16=C%17C(C%13=C%13C%18=C%12C%12=C%11C%11=C9C6=C6C%11=C9C%12=C%11C%18=C%12C%13=C%17C%13=C%16C%16=C(C%17=C%13C%12=C%12C%11=C9C(=C46)C2=C%17%12)C3(C1C1=C[N+](C)=CC=C1)C1=C%16C%15=C8C7=C51)=C%14%10

InChIKey

InChIKey=KIXLRXQGDMRCIL-UHFFFAOYSA-M

Formula

C70H13F3N2O3S

Mass

1018.94

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenanthrenes and derivatives

Subclass

Triphenylenes

Intermediate Tree Nodes

Not available

Direct Parent

Triphenylenes

Alternative Parents

Molecular Framework

Not available

Substituents

Chrysene - Triphenylene - Pyrrolidinylpyridine - Naphthalene - Isoindoline - Isoindole or derivatives - Trifluoromethanesulfonate - N-methylpyridinium - Aralkylamine - Pyridine - Pyridinium - N-alkylpyrrolidine - Methanesulfonate - Pyrrolidine - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Tertiary aliphatic amine - Tertiary amine - Trihalomethane - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Alkyl fluoride - Halomethane - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Alkyl halide - Amine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as triphenylenes. These are compounds containing a triphenylene moiety, which consists of four fused benzene rings forming a 9,10-benzo[l]phenanthrene.

External Descriptors

Not available

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