4-(3,5-dimethyl-4-oxidanyl-phenyl)-2-methylidene-butanal

Systemtic Name: 4-(3,5-dimethyl-4-oxidanyl-phenyl)-2-methylidene-butanal Openeye Name: 4-(4-hydroxy-3,5-dimethyl-phenyl)-2-methylene-butanal CAS Name: 4-(4-hydroxy-3,5-dimethylphenyl)-2-methylenebutanal IUPAC Name: 4-(4-hydroxy-3,5-dimethylphenyl)-2-methylidenebutanal Traditional Name: 2-[2-(4-hydroxy-3,5-dimethyl-phenyl)ethyl]acrolein Formula: C13H16O2 MolecularWeight: 204.26494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CCC(=C)C=O

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CCC(=C)C=O

InChI

InChI=1S/C13H16O2/c1-9(8-14)4-5-12-6-10(2)13(15)11(3)7-12/h6-8,15H,1,4-5H2,2-3H3