(1,3,5-tritert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl) nitrite

Systemtic Name: (1,3,5-tritert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl) nitrite Openeye Name: (1,3,5-tritert-butyl-4-oxo-cyclohexa-2,5-dien-1-yl) nitrite CAS Name: nitrous acid (1,3,5-tritert-butyl-4-oxo-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1,3,5-tritert-butyl-4-oxocyclohexa-2,5-dien-1-yl) nitrite Traditional Name: nitrous acid (1,3,5-tritert-butyl-4-keto-cyclohexa-2,5-dien-1-yl) ester Formula: C18H29NO3 MolecularWeight: 308.421169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(C=C(C1=O)C(C)(C)C)(C(C)(C)C)ON=O

Isomeric SMILES

CC(C)(C)C1=CC(C=C(C1=O)C(C)(C)C)(C(C)(C)C)O[15N]=O

InChI

InChI=1S/C18H29NO3/c1-15(2,3)12-10-18(22-19-21,17(7,8)9)11-13(14(12)20)16(4,5)6/h10-11H,1-9H3/i19+1