4-[5-[5-chloranyl-7-(methoxymethoxymethyl)-1-benzofuran-2-yl]-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-[5-chloranyl-7-(methoxymethoxymethyl)-1-benzofuran-2-yl]-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-[5-chloro-7-(methoxymethoxymethyl)benzofuran-2-yl]-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-[5-chloro-7-(methoxymethoxymethyl)-2-benzofuranyl]-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-[5-chloro-7-(methoxymethoxymethyl)-1-benzofuran-2-yl]-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-[5-chloro-7-(methoxymethoxymethyl)benzofuran-2-yl]-1H-pyrrol-2-yl]benzoic acid Formula: C22H18ClNO5 MolecularWeight: 411.83502

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Descriptors Computed from Structure

Canonical SMILES:

COCOCC1=C2C(=CC(=C1)Cl)C=C(O2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COCOCC1=C2C(=CC(=C1)Cl)C=C(O2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H18ClNO5/c1-27-12-28-11-16-9-17(23)8-15-10-20(29-21(15)16)19-7-6-18(24-19)13-2-4-14(5-3-13)22(25)26/h2-10,24H,11-12H2,1H3,(H,25,26)