Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(SC2=C1C1=C(CCC2)C=CC(=C1)[N+]([O-])=O)N1C(=O)C2=CC3=C(C=C2C1=O)C(=O)N(C3=O)C1=C(C(=O)OCC)C2=C(CCCC3=C2C=C(C=C3)[N+]([O-])=O)S1

InChIKey

InChIKey=KXUJSQUBUHOPAV-UHFFFAOYSA-N

Formula

C42H30N4O12S2

Mass

846.84

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Cycloheptathiophenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cycloheptathiophenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cycloheptathiophene - Isoindolone - Isoindole - Isoindole or derivatives - Nitroaromatic compound - Thiophene carboxylic acid or derivatives - Dicarboxylic acid or derivatives - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - Vinylogous amide - Thiophene - Lactam - C-nitro compound - Carboxylic acid ester - Organic nitro compound - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cycloheptathiophenes. These are polycyclic compounds containing a thiophene ring fused to a 7 member carbocyclic moiety. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom.

External Descriptors

Not available

Previous Back Next