4-ethoxy-3-methyl-2-propyl-benzoic acid

Systemtic Name: 4-ethoxy-3-methyl-2-propyl-benzoic acid Openeye Name: 4-ethoxy-3-methyl-2-propyl-benzoic acid CAS Name: 4-ethoxy-3-methyl-2-propylbenzoic acid IUPAC Name: 4-ethoxy-3-methyl-2-propylbenzoic acid Traditional Name: 4-ethoxy-3-methyl-2-propyl-benzoic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1C)OCC)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1C)OCC)C(=O)O

InChI

InChI=1S/C13H18O3/c1-4-6-10-9(3)12(16-5-2)8-7-11(10)13(14)15/h7-8H,4-6H2,1-3H3,(H,14,15)