Structure Information
Structure

Compound Identification

SMILES

CC1=C(CN[C@H]2CC[C@H](CC3=C(C(N)=NC(NCC4=CC=CC=C4OC(F)(F)F)=N3)[N+]([O-])=O)CC2)C(C)=NO1

InChIKey

InChIKey=ACWOKTRJKCYNTB-SAABIXHNSA-N

Formula

C25H30F3N7O4

Mass

549.555

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenol ethers

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenoxy compound - Nitroaromatic compound - Benzylamine - Phenol ether - Aminopyrimidine - Cyclohexylamine - Aralkylamine - Monocyclic benzene moiety - Imidolactam - Pyrimidine - Azole - Heteroaromatic compound - Isoxazole - Trihalomethane - C-nitro compound - Organic nitro compound - Secondary aliphatic amine - Oxacycle - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organofluoride - Organic nitrogen compound - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Organooxygen compound - Primary amine - Organic salt - Organic oxygen compound - Organic zwitterion - Organic oxide - Halomethane - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.

External Descriptors

Not available

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