Structure Information
Structure

Compound Identification

SMILES

CC(C)C(=O)OC[N+]1=CN(C[C@@](O)([C@@H](C)N2CCN(C2=O)C2=CC=C(C=C2)N2C=NN=N2)C2=C(F)C=C(F)C=C2)N=C1

InChIKey

InChIKey=ONJBXHNWCZRPMW-XHCCPWGMSA-N

Formula

C27H30F2N9O4

Mass

582.592

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Tetrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenyltetrazoles and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylimidazolidine - Phenyltetrazole - Phenylpropane - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidazolidinone - Benzenoid - Heteroaromatic compound - Imidazolidine - 1,2,4-triazole - Tertiary alcohol - Carboxylic acid ester - Urea - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Alcohol - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyltetrazoles and derivatives. These are compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.

External Descriptors

Not available

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