2-methoxy-5-(3-methyl-3-oxidanyl-but-1-ynyl)benzaldehyde

Systemtic Name: 2-methoxy-5-(3-methyl-3-oxidanyl-but-1-ynyl)benzaldehyde Openeye Name: 5-(3-hydroxy-3-methyl-but-1-ynyl)-2-methoxy-benzaldehyde CAS Name: 5-(3-hydroxy-3-methylbut-1-ynyl)-2-methoxybenzaldehyde IUPAC Name: 5-(3-hydroxy-3-methylbut-1-ynyl)-2-methoxybenzaldehyde Traditional Name: 5-(3-hydroxy-3-methyl-but-1-ynyl)-2-methoxy-benzaldehyde Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O3/c1-13(2,15)7-6-10-4-5-12(16-3)11(8-10)9-14/h4-5,8-9,15H,1-3H3