(6-tert-butyl-2,2-dimethyl-4-oxidanylidene-3H-chromen-7-yl) cyanate

Systemtic Name: (6-tert-butyl-2,2-dimethyl-4-oxidanylidene-3H-chromen-7-yl) cyanate Openeye Name: (6-tert-butyl-2,2-dimethyl-4-oxo-chroman-7-yl) cyanate CAS Name: cyanic acid (6-tert-butyl-2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl) ester IUPAC Name: (6-tert-butyl-2,2-dimethyl-4-oxo-3H-chromen-7-yl) cyanate Traditional Name: cyanic acid (6-tert-butyl-4-keto-2,2-dimethyl-chroman-7-yl) ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=CC(=C(C=C2O1)OC#N)C(C)(C)C)C

Isomeric SMILES

CC1(CC(=O)C2=CC(=C(C=C2O1)OC#N)C(C)(C)C)C

InChI

InChI=1S/C16H19NO3/c1-15(2,3)11-6-10-12(18)8-16(4,5)20-13(10)7-14(11)19-9-17/h6-7H,8H2,1-5H3