3-[4-(2-carboxyethyl)-2,5-dimethyl-phenyl]propanoic acid

Systemtic Name: 3-[4-(2-carboxyethyl)-2,5-dimethyl-phenyl]propanoic acid Openeye Name: 3-[4-(2-carboxyethyl)-2,5-dimethyl-phenyl]propanoic acid CAS Name: 3-[4-(2-carboxyethyl)-2,5-dimethylphenyl]propanoic acid IUPAC Name: 3-[4-(2-carboxyethyl)-2,5-dimethylphenyl]propanoic acid Traditional Name: 3-[4-(2-carboxyethyl)-2,5-dimethyl-phenyl]propionic acid Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CCC(=O)O)C)CCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1CCC(=O)O)C)CCC(=O)O

InChI

InChI=1S/C14H18O4/c1-9-7-12(4-6-14(17)18)10(2)8-11(9)3-5-13(15)16/h7-8H,3-6H2,1-2H3,(H,15,16)(H,17,18)