3-(2-carboxyhexyl)benzoic acid

Systemtic Name: 3-(2-carboxyhexyl)benzoic acid Openeye Name: 3-(2-carboxyhexyl)benzoic acid CAS Name: 3-(2-carboxyhexyl)benzoic acid IUPAC Name: 3-(2-carboxyhexyl)benzoic acid Traditional Name: 3-(2-carboxyhexyl)benzoic acid Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O4/c1-2-3-6-11(13(15)16)8-10-5-4-7-12(9-10)14(17)18/h4-5,7,9,11H,2-3,6,8H2,1H3,(H,15,16)(H,17,18)