Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CO[C@H](OCC2=CC=CC=C2)[C@H]2[C@@H]1CC1OC(C)(C)OC21CNC(=O)NC1=CN=CC=C1

InChIKey

InChIKey=AXRVLHGXHMLTTQ-VYRFUFGISA-N

Formula

C27H31N3O7

Mass

509.559

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Ethers

Intermediate Tree Nodes

Acetals

Direct Parent

Ketals

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Ketal - Monocyclic benzene moiety - Pyridine - Benzenoid - Meta-dioxolane - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous ester - Heteroaromatic compound - Urea - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Organic oxide - Carbonyl group - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as ketals. These are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals.

External Descriptors

Not available

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