4-[4-(tert-butyldiazenyl)-4-cyano-pentoxy]carbonylphthalic acid

Systemtic Name: 4-[4-(tert-butyldiazenyl)-4-cyano-pentoxy]carbonylphthalic acid Openeye Name: 4-(4-tert-butylazo-4-cyano-pentoxy)carbonylphthalic acid CAS Name: 4-[(4-tert-butylazo-4-cyanopentoxy)-oxomethyl]phthalic acid IUPAC Name: 4-[4-(tert-butyldiazenyl)-4-cyanopentoxy]carbonylphthalic acid Traditional Name: 4-(4-tert-butylazo-4-cyano-pentoxy)carbonylphthalic acid Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=NC(C)(CCCOC(=O)C1=CC(=C(C=C1)C(=O)O)C(=O)O)C#N

Isomeric SMILES

CC(C)(C)N=NC(C)(CCCOC(=O)C1=CC(=C(C=C1)C(=O)O)C(=O)O)C#N

InChI

InChI=1S/C19H23N3O6/c1-18(2,3)21-22-19(4,11-20)8-5-9-28-17(27)12-6-7-13(15(23)24)14(10-12)16(25)26/h6-7,10H,5,8-9H2,1-4H3,(H,23,24)(H,25,26)