3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]-7-oxidanyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]-7-oxidanyl-1-benzofuran-2-carboxylic acid Openeye Name: 7-hydroxy-3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]benzofuran-2-carboxylic acid CAS Name: 7-hydroxy-3-[2-[4-(2-methoxyphenyl)-1-piperazinyl]propoxy]-2-benzofurancarboxylic acid IUPAC Name: 7-hydroxy-3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]-1-benzofuran-2-carboxylic acid Traditional Name: 7-hydroxy-3-[2-[4-(2-methoxyphenyl)piperazino]propoxy]coumarilic acid Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(OC2=C1C=CC=C2O)C(=O)O)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC(COC1=C(OC2=C1C=CC=C2O)C(=O)O)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C23H26N2O6/c1-15(24-10-12-25(13-11-24)17-7-3-4-9-19(17)29-2)14-30-21-16-6-5-8-18(26)20(16)31-22(21)23(27)28/h3-9,15,26H,10-14H2,1-2H3,(H,27,28)