4-(1-propoxypropan-2-yl)benzoic acid

Systemtic Name: 4-(1-propoxypropan-2-yl)benzoic acid Openeye Name: 4-(1-methyl-2-propoxy-ethyl)benzoic acid CAS Name: 4-(1-propoxypropan-2-yl)benzoic acid IUPAC Name: 4-(1-propoxypropan-2-yl)benzoic acid Traditional Name: 4-(1-methyl-2-propoxy-ethyl)benzoic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-3-8-16-9-10(2)11-4-6-12(7-5-11)13(14)15/h4-7,10H,3,8-9H2,1-2H3,(H,14,15)