(2S)-2-(2,5-dimethylphenyl)butanal

Systemtic Name: (2S)-2-(2,5-dimethylphenyl)butanal Openeye Name: (2S)-2-(2,5-dimethylphenyl)butanal CAS Name: (2S)-2-(2,5-dimethylphenyl)butanal IUPAC Name: (2S)-2-(2,5-dimethylphenyl)butanal Traditional Name: (2S)-2-(2,5-dimethylphenyl)butyraldehyde Formula: C12H16O MolecularWeight: 176.25484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C=O)C1=C(C=CC(=C1)C)C

InChI

InChI=1S/C12H16O/c1-4-11(8-13)12-7-9(2)5-6-10(12)3/h5-8,11H,4H2,1-3H3/t11-/m1/s1