Compound Identification
SMILES
COC1=C(OCC2=CC=C(Cl)C=C2)C=CC(C=NNC(=O)C2=C(CN3CCC(C)CC3)N(N=N2)C2=NON=C2N)=C1
InChIKey
InChIKey=YRPYQZQPJNDKJK-UHFFFAOYSA-N
Formula
C27H30ClN9O4
Mass
580.05
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
-
Class
Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Anisoles
Intermediate Tree Nodes
Not available
Direct Parent
Anisoles
Alternative Parents
Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aralkylamines Chlorobenzenes Imidolactams Aryl chlorides Piperidines Triazoles Vinylogous amides Heteroaromatic compounds Furazans Amino acids and derivatives Trialkylamines Oxacyclic compounds Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Imidolactam - Azole - Heteroaromatic compound - Furazan - Oxadiazole - 1,2,3-triazole - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Ether - Azacycle - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Primary amine - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors
Not available