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

Systemtic Name: methyl 2-[(4-cyano-2-methyl-1-oxidanyl-butan-2-yl)diazenyl]benzoate Openeye Name: methyl 2-[3-cyano-1-(hydroxymethyl)-1-methyl-propyl]azobenzoate CAS Name: 2-(4-cyano-1-hydroxy-2-methylbutan-2-yl)azobenzoic acid methyl ester IUPAC Name: methyl 2-[(4-cyano-1-hydroxy-2-methylbutan-2-yl)diazenyl]benzoate Traditional Name: 2-(3-cyano-1-methyl-1-methylol-propyl)azobenzoic acid methyl ester Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3/c1-14(10-18,8-5-9-15)17-16-12-7-4-3-6-11(12)13(19)20-2/h3-4,6-7,18H,5,8,10H2,1-2H3