1-[3,5-di(propan-2-yl)phenyl]-2-heptoxy-ethanone

Systemtic Name: 1-[3,5-di(propan-2-yl)phenyl]-2-heptoxy-ethanone Openeye Name: 1-(3,5-diisopropylphenyl)-2-heptoxy-ethanone CAS Name: 1-[3,5-di(propan-2-yl)phenyl]-2-heptoxyethanone IUPAC Name: 1-[3,5-di(propan-2-yl)phenyl]-2-heptoxyethanone Traditional Name: 1-(3,5-diisopropylphenyl)-2-heptoxy-ethanone Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCC(=O)C1=CC(=CC(=C1)C(C)C)C(C)C

Isomeric SMILES

CCCCCCCOCC(=O)C1=CC(=CC(=C1)C(C)C)C(C)C

InChI

InChI=1S/C21H34O2/c1-6-7-8-9-10-11-23-15-21(22)20-13-18(16(2)3)12-19(14-20)17(4)5/h12-14,16-17H,6-11,15H2,1-5H3