2-[3-[1,5-bis(4-chlorophenyl)-3H-2-benzofuran-1-yl]propyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[3-[1,5-bis(4-chlorophenyl)-3H-2-benzofuran-1-yl]propyl-methyl-amino]ethanoic acid Openeye Name: 2-[3-[1,5-bis(4-chlorophenyl)-3H-isobenzofuran-1-yl]propyl-methyl-amino]acetic acid CAS Name: 2-[3-[1,5-bis(4-chlorophenyl)-3H-isobenzofuran-1-yl]propyl-methylamino]acetic acid IUPAC Name: 2-[3-[1,5-bis(4-chlorophenyl)-3H-2-benzofuran-1-yl]propyl-methylamino]acetic acid Traditional Name: 2-[3-[1,5-bis(4-chlorophenyl)phthalan-1-yl]propyl-methyl-amino]acetic acid Formula: C26H25Cl2NO3 MolecularWeight: 470.3876

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1(C2=C(CO1)C=C(C=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)CC(=O)O

Isomeric SMILES

CN(CCCC1(C2=C(CO1)C=C(C=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)CC(=O)O

InChI

InChI=1S/C26H25Cl2NO3/c1-29(16-25(30)31)14-2-13-26(21-6-10-23(28)11-7-21)24-12-5-19(15-20(24)17-32-26)18-3-8-22(27)9-4-18/h3-12,15H,2,13-14,16-17H2,1H3,(H,30,31)