methyl 2-[(5-ethoxy-2-methyl-1-oxidanyl-5-oxidanylidene-pentan-2-yl)diazenyl]benzoate

Systemtic Name: methyl 2-[(5-ethoxy-2-methyl-1-oxidanyl-5-oxidanylidene-pentan-2-yl)diazenyl]benzoate Openeye Name: methyl 2-[4-ethoxy-1-(hydroxymethyl)-1-methyl-4-oxo-butyl]azobenzoate CAS Name: 2-(5-ethoxy-1-hydroxy-2-methyl-5-oxopentan-2-yl)azobenzoic acid methyl ester IUPAC Name: methyl 2-[(5-ethoxy-1-hydroxy-2-methyl-5-oxopentan-2-yl)diazenyl]benzoate Traditional Name: 2-(4-ethoxy-4-keto-1-methyl-1-methylol-butyl)azobenzoic acid methyl ester Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C)(CO)N=NC1=CC=CC=C1C(=O)OC

Isomeric SMILES

CCOC(=O)CCC(C)(CO)N=NC1=CC=CC=C1C(=O)OC

InChI

InChI=1S/C16H22N2O5/c1-4-23-14(20)9-10-16(2,11-19)18-17-13-8-6-5-7-12(13)15(21)22-3/h5-8,19H,4,9-11H2,1-3H3