1-(4-tert-butylphenyl)-2-(2-oxidanyldodecan-5-yl)-3-phenyl-propane-1,3-dione

Systemtic Name: 1-(4-tert-butylphenyl)-2-(2-oxidanyldodecan-5-yl)-3-phenyl-propane-1,3-dione Openeye Name: 1-(4-tert-butylphenyl)-2-[1-(3-hydroxybutyl)octyl]-3-phenyl-propane-1,3-dione CAS Name: 1-(4-tert-butylphenyl)-2-(2-hydroxydodecan-5-yl)-3-phenylpropane-1,3-dione IUPAC Name: 1-(4-tert-butylphenyl)-2-(2-hydroxydodecan-5-yl)-3-phenylpropane-1,3-dione Traditional Name: 1-(4-tert-butylphenyl)-2-[1-(3-hydroxybutyl)octyl]-3-phenyl-propane-1,3-dione Formula: C31H44O3 MolecularWeight: 464.67926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H44O3/c1-6-7-8-9-11-14-24(18-17-23(2)32)28(29(33)25-15-12-10-13-16-25)30(34)26-19-21-27(22-20-26)31(3,4)5/h10,12-13,15-16,19-24,28,32H,6-9,11,14,17-18H2,1-5H3