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

Systemtic Name: 4-[5-(5-chloranyl-7-propan-2-yl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(5-chloro-7-isopropyl-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(5-chloro-7-propan-2-yl-2-benzofuranyl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(5-chloro-7-propan-2-yl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(5-chloro-7-isopropyl-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Formula: C22H18ClNO3 MolecularWeight: 379.83622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClNO3/c1-12(2)17-11-16(23)9-15-10-20(27-21(15)17)19-8-7-18(24-19)13-3-5-14(6-4-13)22(25)26/h3-12,24H,1-2H3,(H,25,26)