2-methylpropanal; 2-[4-(2-methylpropyl)phenyl]propanoic acid

Systemtic Name: 2-methylpropanal; 2-[4-(2-methylpropyl)phenyl]propanoic acid Openeye Name: 2-(4-isobutylphenyl)propanoic acid; 2-methylpropanal CAS Name: 2-methylpropanal; 2-[4-(2-methylpropyl)phenyl]propanoic acid IUPAC Name: 2-methylpropanal; 2-[4-(2-methylpropyl)phenyl]propanoic acid Traditional Name: 2-(4-isobutylphenyl)propionic acid; 2-methylpropionaldehyde Formula: C17H26O3 MolecularWeight: 278.38654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.CC(C)C=O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.CC(C)C=O

InChI

InChI=1S/C13H18O2.C4H8O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;1-4(2)3-5/h4-7,9-10H,8H2,1-3H3,(H,14,15);3-4H,1-2H3