3-[3-(4-oxidanylidenebutan-2-yl)phenyl]butanal

Systemtic Name: 3-[3-(4-oxidanylidenebutan-2-yl)phenyl]butanal Openeye Name: 3-[3-(1-methyl-3-oxo-propyl)phenyl]butanal CAS Name: 3-[3-(4-oxobutan-2-yl)phenyl]butanal IUPAC Name: 3-[3-(4-oxobutan-2-yl)phenyl]butanal Traditional Name: 3-[3-(3-keto-1-methyl-propyl)phenyl]butyraldehyde Formula: C14H18O2 MolecularWeight: 218.29152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O2/c1-11(6-8-15)13-4-3-5-14(10-13)12(2)7-9-16/h3-5,8-12H,6-7H2,1-2H3