3-methyl-4-oxidanylidene-3-phenyl-pentanal

Systemtic Name: 3-methyl-4-oxidanylidene-3-phenyl-pentanal Openeye Name: 3-methyl-4-oxo-3-phenyl-pentanal CAS Name: 3-methyl-4-oxo-3-phenylpentanal IUPAC Name: 3-methyl-4-oxo-3-phenylpentanal Traditional Name: 4-keto-3-methyl-3-phenyl-valeraldehyde Formula: C12H14O2 MolecularWeight: 190.23836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O2/c1-10(14)12(2,8-9-13)11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3