1,7-bis(5-tert-butyl-2-methyl-phenyl)heptan-4-one

Systemtic Name: 1,7-bis(5-tert-butyl-2-methyl-phenyl)heptan-4-one Openeye Name: 1,7-bis(5-tert-butyl-2-methyl-phenyl)heptan-4-one CAS Name: 1,7-bis(5-tert-butyl-2-methylphenyl)-4-heptanone IUPAC Name: 1,7-bis(5-tert-butyl-2-methylphenyl)heptan-4-one Traditional Name: 1,7-bis(5-tert-butyl-2-methyl-phenyl)heptan-4-one Formula: C29H42O MolecularWeight: 406.64318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)CCCC(=O)CCCC2=C(C=CC(=C2)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)CCCC(=O)CCCC2=C(C=CC(=C2)C(C)(C)C)C

InChI

InChI=1S/C29H42O/c1-21-15-17-25(28(3,4)5)19-23(21)11-9-13-27(30)14-10-12-24-20-26(29(6,7)8)18-16-22(24)2/h15-20H,9-14H2,1-8H3