3-(3-tert-butyl-4-oxidanyl-phenyl)propanal

Systemtic Name: 3-(3-tert-butyl-4-oxidanyl-phenyl)propanal Openeye Name: 3-(3-tert-butyl-4-hydroxy-phenyl)propanal CAS Name: 3-(3-tert-butyl-4-hydroxyphenyl)propanal IUPAC Name: 3-(3-tert-butyl-4-hydroxyphenyl)propanal Traditional Name: 3-(3-tert-butyl-4-hydroxy-phenyl)propionaldehyde Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O2/c1-13(2,3)11-9-10(5-4-8-14)6-7-12(11)15/h6-9,15H,4-5H2,1-3H3