dodecyl 2,2-dimethyl-3-oxidanyl-4-oxidanylidene-3-phenyl-pentanoate

Systemtic Name: dodecyl 2,2-dimethyl-3-oxidanyl-4-oxidanylidene-3-phenyl-pentanoate Openeye Name: dodecyl 3-hydroxy-2,2-dimethyl-4-oxo-3-phenyl-pentanoate CAS Name: 3-hydroxy-2,2-dimethyl-4-oxo-3-phenylpentanoic acid dodecyl ester IUPAC Name: dodecyl 3-hydroxy-2,2-dimethyl-4-oxo-3-phenylpentanoate Traditional Name: 3-hydroxy-4-keto-2,2-dimethyl-3-phenyl-valeric acid lauryl ester Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(C)(C)C(C1=CC=CC=C1)(C(=O)C)O

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(C)(C)C(C1=CC=CC=C1)(C(=O)C)O

InChI

InChI=1S/C25H40O4/c1-5-6-7-8-9-10-11-12-13-17-20-29-23(27)24(3,4)25(28,21(2)26)22-18-15-14-16-19-22/h14-16,18-19,28H,5-13,17,20H2,1-4H3