2-[3-[6-chloranyl-1-(4-methoxyphenyl)-3H-2-benzofuran-1-yl]propyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[3-[6-chloranyl-1-(4-methoxyphenyl)-3H-2-benzofuran-1-yl]propyl-methyl-amino]ethanoic acid Openeye Name: 2-[3-[6-chloro-1-(4-methoxyphenyl)-3H-isobenzofuran-1-yl]propyl-methyl-amino]acetic acid CAS Name: 2-[3-[6-chloro-1-(4-methoxyphenyl)-3H-isobenzofuran-1-yl]propyl-methylamino]acetic acid IUPAC Name: 2-[3-[6-chloro-1-(4-methoxyphenyl)-3H-2-benzofuran-1-yl]propyl-methylamino]acetic acid Traditional Name: 2-[3-[6-chloro-1-(4-methoxyphenyl)phthalan-1-yl]propyl-methyl-amino]acetic acid Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClNO4/c1-23(13-20(24)25)11-3-10-21(16-5-8-18(26-2)9-6-16)19-12-17(22)7-4-15(19)14-27-21/h4-9,12H,3,10-11,13-14H2,1-2H3,(H,24,25)