3-[3,6-bis(dicyanomethylidene)cyclohexa-1,4-dien-1-yl]propanoic acid

Systemtic Name: 3-[3,6-bis(dicyanomethylidene)cyclohexa-1,4-dien-1-yl]propanoic acid Openeye Name: 3-[3,6-bis(dicyanomethylene)cyclohexa-1,4-dien-1-yl]propanoic acid CAS Name: 3-[3,6-bis(dicyanomethylidene)-1-cyclohexa-1,4-dienyl]propanoic acid IUPAC Name: 3-[3,6-bis(dicyanomethylidene)cyclohexa-1,4-dien-1-yl]propanoic acid Traditional Name: 3-[3,6-bis(dicyanomethylene)cyclohexa-1,4-dien-1-yl]propionic acid Formula: C15H8N4O2 MolecularWeight: 276.24962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C#N)C#N)C(=CC1=C(C#N)C#N)CCC(=O)O

Isomeric SMILES

C1=CC(=C(C#N)C#N)C(=CC1=C(C#N)C#N)CCC(=O)O

InChI

InChI=1S/C15H8N4O2/c16-6-12(7-17)10-1-3-14(13(8-18)9-19)11(5-10)2-4-15(20)21/h1,3,5H,2,4H2,(H,20,21)