1-(5-tert-butyl-2-methyl-6-oxidanyl-3-propan-2-yl-phenyl)heptan-1-one

Systemtic Name: 1-(5-tert-butyl-2-methyl-6-oxidanyl-3-propan-2-yl-phenyl)heptan-1-one Openeye Name: 1-(3-tert-butyl-2-hydroxy-5-isopropyl-6-methyl-phenyl)heptan-1-one CAS Name: 1-(3-tert-butyl-2-hydroxy-6-methyl-5-propan-2-ylphenyl)-1-heptanone IUPAC Name: 1-(3-tert-butyl-2-hydroxy-6-methyl-5-propan-2-ylphenyl)heptan-1-one Traditional Name: 1-(3-tert-butyl-2-hydroxy-5-isopropyl-6-methyl-phenyl)heptan-1-one Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=C(C(=CC(=C1O)C(C)(C)C)C(C)C)C

Isomeric SMILES

CCCCCCC(=O)C1=C(C(=CC(=C1O)C(C)(C)C)C(C)C)C

InChI

InChI=1S/C21H34O2/c1-8-9-10-11-12-18(22)19-15(4)16(14(2)3)13-17(20(19)23)21(5,6)7/h13-14,23H,8-12H2,1-7H3