Compound Identification
SMILES
OS(=O)(=O)C1=CC2=C(N=C(O2)C(=O)COC2=CC=C(OCC(=O)C3=NC4=C(O3)C=C(C3=CC=CC=C43)S(O)(=O)=O)C=C2)C2=CC=CC=C12
InChIKey
InChIKey=ZJZICDKXTREYME-UHFFFAOYSA-N
Formula
C32H20N2O12S2
Mass
688.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
-
Level 5
Naphthalene sulfonates
- Level 6 1-naphthalene sulfonates
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Level 5
Naphthalene sulfonates
-
Subclass
Naphthalene sulfonic acids and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Naphthalene sulfonates
Direct Parent
1-naphthalene sulfonates
Alternative Parents
1-naphthalene sulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzoxazoles Phenoxy compounds Phenol ethers Aryl alkyl ketones Alkyl aryl ethers Sulfonyls Oxazoles Organosulfonic acids Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organic oxides Organonitrogen compounds Aldehydes Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzoxazole - Phenoxy compound - Aryl ketone - Aryl alkyl ketone - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Azole - Organosulfonic acid or derivatives - Oxazole - Heteroaromatic compound - Ketone - Azacycle - Oxacycle - Ether - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available