2-methyl-3-[4-(2-methylhexan-2-yl)phenyl]propanal

Systemtic Name: 2-methyl-3-[4-(2-methylhexan-2-yl)phenyl]propanal Openeye Name: 3-[4-(1,1-dimethylpentyl)phenyl]-2-methyl-propanal CAS Name: 2-methyl-3-[4-(2-methylhexan-2-yl)phenyl]propanal IUPAC Name: 2-methyl-3-[4-(2-methylhexan-2-yl)phenyl]propanal Traditional Name: 3-[4-(1,1-dimethylpentyl)phenyl]-2-methyl-propionaldehyde Formula: C17H26O MolecularWeight: 246.38774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O/c1-5-6-11-17(3,4)16-9-7-15(8-10-16)12-14(2)13-18/h7-10,13-14H,5-6,11-12H2,1-4H3