Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(CN[C@@H]2CCC3=C(C2)C(=NN3CC=C)C(=O)N2CC[NH+](C)CC2)=C1OC

InChIKey

InChIKey=ODIMPGAMSLTVTD-LJQANCHMSA-O

Formula

C25H36N5O3

Mass

454.594

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Methoxybenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Dimethoxybenzenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dimethoxybenzene - O-dimethoxybenzene - 2-heteroaryl carboxamide - Phenylmethylamine - Phenoxy compound - Phenol ether - Anisole - Pyrazole-5-carboxamide - Benzylamine - Alkyl aryl ether - N-methylpiperazine - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Pyrazole - Tertiary carboxylic acid amide - Quaternary ammonium salt - Azole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Secondary amine - Organic oxygen compound - Amine - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.

External Descriptors

Not available

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