(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-(4-methylphenyl)azanium

Systemtic Name: (3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-(4-methylphenyl)azanium Openeye Name: (3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-(p-tolyl)ammonium CAS Name: (3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-(4-methylphenyl)ammonium IUPAC Name: (3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(4-methylphenyl)azanium Traditional Name: (3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-(p-tolyl)ammonium Formula: C21H28NO+ MolecularWeight: 310.45312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[NH+]=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[NH+]=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C21H27NO/c1-14-8-10-15(11-9-14)22-16-12-17(20(2,3)4)19(23)18(13-16)21(5,6)7/h8-13H,1-7H3/p+1