2-[3-(carboxymethyl)-2-(2-iodyloctadecoxy)phenyl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-2-(2-iodyloctadecoxy)phenyl]ethanoic acid Openeye Name: 2-[3-(carboxymethyl)-2-(2-iodyloctadecoxy)phenyl]acetic acid CAS Name: 2-[3-(carboxymethyl)-2-(2-iodyloctadecoxy)phenyl]acetic acid IUPAC Name: 2-[3-(carboxymethyl)-2-(2-iodyloctadecoxy)phenyl]acetic acid Traditional Name: 2-[3-(carboxymethyl)-2-(2-iodyloctadecoxy)phenyl]acetic acid Formula: C28H45IO7 MolecularWeight: 620.55717

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(COC1=C(C=CC=C1CC(=O)O)CC(=O)O)I(=O)=O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(COC1=C(C=CC=C1CC(=O)O)CC(=O)O)I(=O)=O

InChI

InChI=1S/C28H45IO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25(29(34)35)22-36-28-23(20-26(30)31)17-16-18-24(28)21-27(32)33/h16-18,25H,2-15,19-22H2,1H3,(H,30,31)(H,32,33)