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

Systemtic Name: 2-[2-[1,5-bis(4-chlorophenyl)-3H-2-benzofuran-1-yl]ethyl-methyl-amino]ethanoic acid Openeye Name: 2-[2-[1,5-bis(4-chlorophenyl)-3H-isobenzofuran-1-yl]ethyl-methyl-amino]acetic acid CAS Name: 2-[2-[1,5-bis(4-chlorophenyl)-3H-isobenzofuran-1-yl]ethyl-methylamino]acetic acid IUPAC Name: 2-[2-[1,5-bis(4-chlorophenyl)-3H-2-benzofuran-1-yl]ethyl-methylamino]acetic acid Traditional Name: 2-[2-[1,5-bis(4-chlorophenyl)phthalan-1-yl]ethyl-methyl-amino]acetic acid Formula: C25H23Cl2NO3 MolecularWeight: 456.36102

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1(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(CCC1(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/C25H23Cl2NO3/c1-28(15-24(29)30)13-12-25(20-5-9-22(27)10-6-20)23-11-4-18(14-19(23)16-31-25)17-2-7-21(26)8-3-17/h2-11,14H,12-13,15-16H2,1H3,(H,29,30)