[3-oxidanyl-4-(phenylcarbonyl)phenyl] 4-(tert-butyldiazenyl)-4-cyano-pentanoate

Systemtic Name: [3-oxidanyl-4-(phenylcarbonyl)phenyl] 4-(tert-butyldiazenyl)-4-cyano-pentanoate Openeye Name: (4-benzoyl-3-hydroxy-phenyl) 4-tert-butylazo-4-cyano-pentanoate CAS Name: 4-tert-butylazo-4-cyanopentanoic acid (4-benzoyl-3-hydroxyphenyl) ester IUPAC Name: (4-benzoyl-3-hydroxyphenyl) 4-(tert-butyldiazenyl)-4-cyanopentanoate Traditional Name: 4-tert-butylazo-4-cyano-valeric acid (4-benzoyl-3-hydroxy-phenyl) ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=NC(C)(CCC(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O)C#N

Isomeric SMILES

CC(C)(C)N=NC(C)(CCC(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O)C#N

InChI

InChI=1S/C23H25N3O4/c1-22(2,3)25-26-23(4,15-24)13-12-20(28)30-17-10-11-18(19(27)14-17)21(29)16-8-6-5-7-9-16/h5-11,14,27H,12-13H2,1-4H3