Structure Information
Structure

Compound Identification

SMILES

Br.COC1=C(F)C=C(C=C1)N(CC1=CSC=C1)C(=O)O[C@H]1C[N+]2(C\C=C\C3=CC=CC=C3)CCC1CC2

InChIKey

InChIKey=HLMDMIGUSFMLRK-OHQHPXSVSA-N

Formula

C29H33BrFN2O3S

Mass

588.56

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylcarbamic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Phenylcarbamic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylcarbamic acid ester - Methoxyaniline - Anisole - Phenol ether - Quinuclidine - Styrene - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Piperidine - Tetraalkylammonium salt - Heteroaromatic compound - Carbamic acid ester - Thiophene - Quaternary ammonium salt - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Hydrobromide - Organic oxide - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.

External Descriptors

Not available

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