3-ethoxy-4-iodanyl-5-phenylmethoxy-benzoic acid

Systemtic Name: 3-ethoxy-4-iodanyl-5-phenylmethoxy-benzoic acid Openeye Name: 3-benzyloxy-5-ethoxy-4-iodo-benzoic acid CAS Name: 3-ethoxy-4-iodo-5-phenylmethoxybenzoic acid IUPAC Name: 3-ethoxy-4-iodo-5-phenylmethoxybenzoic acid Traditional Name: 3-benzoxy-5-ethoxy-4-iodo-benzoic acid Formula: C16H15IO4 MolecularWeight: 398.19237

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1I)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCOC1=CC(=CC(=C1I)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H15IO4/c1-2-20-13-8-12(16(18)19)9-14(15(13)17)21-10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,18,19)