Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CN2C(=O)O\C(=C/C#N)C3=C2C2(OCCO2)[C@@H](O)[C@](O)(C3)C#C)C=C1

InChIKey

InChIKey=NIHURPQMPRYPOO-YMPWWNIDSA-N

Formula

C22H20N2O7

Mass

424.409

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Entity with smiles COC1=CC=C(CN2C(=O)O\C(=C/C#N)C3=C2C2(OCCO2)[C@@H](O)[C@](O)(C3)C#C)C=C1 has not been classified yet.

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