(4,4-ditert-butylcyclohexa-2,5-dien-1-yl)-phenyl-methanone

Systemtic Name: (4,4-ditert-butylcyclohexa-2,5-dien-1-yl)-phenyl-methanone Openeye Name: (4,4-ditert-butylcyclohexa-2,5-dien-1-yl)-phenyl-methanone CAS Name: (4,4-ditert-butyl-1-cyclohexa-2,5-dienyl)-phenylmethanone IUPAC Name: (4,4-ditert-butylcyclohexa-2,5-dien-1-yl)-phenylmethanone Traditional Name: (4,4-ditert-butylcyclohexa-2,5-dien-1-yl)-phenyl-methanone Formula: C21H28O MolecularWeight: 296.44642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C=CC(C=C1)C(=O)C2=CC=CC=C2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1(C=CC(C=C1)C(=O)C2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C21H28O/c1-19(2,3)21(20(4,5)6)14-12-17(13-15-21)18(22)16-10-8-7-9-11-16/h7-15,17H,1-6H3