methyl 2-[(1-acetyloxy-4-cyano-butan-2-yl)diazenyl]benzoate

Systemtic Name: methyl 2-[(1-acetyloxy-4-cyano-butan-2-yl)diazenyl]benzoate Openeye Name: methyl 2-[1-(acetoxymethyl)-3-cyano-propyl]azobenzoate CAS Name: 2-(1-acetyloxy-4-cyanobutan-2-yl)azobenzoic acid methyl ester IUPAC Name: methyl 2-[(1-acetyloxy-4-cyanobutan-2-yl)diazenyl]benzoate Traditional Name: 2-[1-(acetoxymethyl)-3-cyano-propyl]azobenzoic acid methyl ester Formula: C15H17N3O4 MolecularWeight: 303.31318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CCC#N)N=NC1=CC=CC=C1C(=O)OC

Isomeric SMILES

CC(=O)OCC(CCC#N)N=NC1=CC=CC=C1C(=O)OC

InChI

InChI=1S/C15H17N3O4/c1-11(19)22-10-12(6-5-9-16)17-18-14-8-4-3-7-13(14)15(20)21-2/h3-4,7-8,12H,5-6,10H2,1-2H3