4-methyl-2-(3-methyl-3-oxidanyl-but-1-ynyl)-6-oxidanyl-benzaldehyde

Systemtic Name: 4-methyl-2-(3-methyl-3-oxidanyl-but-1-ynyl)-6-oxidanyl-benzaldehyde Openeye Name: 2-hydroxy-6-(3-hydroxy-3-methyl-but-1-ynyl)-4-methyl-benzaldehyde CAS Name: 2-hydroxy-6-(3-hydroxy-3-methylbut-1-ynyl)-4-methylbenzaldehyde IUPAC Name: 2-hydroxy-6-(3-hydroxy-3-methylbut-1-ynyl)-4-methylbenzaldehyde Traditional Name: 2-hydroxy-6-(3-hydroxy-3-methyl-but-1-ynyl)-4-methyl-benzaldehyde Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C#CC(C)(C)O)C=O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)C#CC(C)(C)O)C=O)O

InChI

InChI=1S/C13H14O3/c1-9-6-10(4-5-13(2,3)16)11(8-14)12(15)7-9/h6-8,15-16H,1-3H3