2-[3-(carboxymethyl)-5-heptoxy-phenyl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-5-heptoxy-phenyl]ethanoic acid Openeye Name: 2-[3-(carboxymethyl)-5-heptoxy-phenyl]acetic acid CAS Name: 2-[3-(carboxymethyl)-5-heptoxyphenyl]acetic acid IUPAC Name: 2-[3-(carboxymethyl)-5-heptoxyphenyl]acetic acid Traditional Name: 2-[3-(carboxymethyl)-5-heptoxy-phenyl]acetic acid Formula: C17H24O5 MolecularWeight: 308.36946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=CC(=C1)CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCOC1=CC(=CC(=C1)CC(=O)O)CC(=O)O

InChI

InChI=1S/C17H24O5/c1-2-3-4-5-6-7-22-15-9-13(11-16(18)19)8-14(10-15)12-17(20)21/h8-10H,2-7,11-12H2,1H3,(H,18,19)(H,20,21)