(1,3,5-tritert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-yl) nitrite

Systemtic Name: (1,3,5-tritert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-yl) nitrite Openeye Name: (1,3,5-tritert-butyl-6-oxo-cyclohexa-2,4-dien-1-yl) nitrite CAS Name: nitrous acid (1,3,5-tritert-butyl-6-oxo-1-cyclohexa-2,4-dienyl) ester IUPAC Name: (1,3,5-tritert-butyl-6-oxocyclohexa-2,4-dien-1-yl) nitrite Traditional Name: nitrous acid (1,3,5-tritert-butyl-6-keto-cyclohexa-2,4-dien-1-yl) ester Formula: C18H29NO3 MolecularWeight: 308.421169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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