1-(2,3-dihydro-1-benzofuran-4-yloxy)-3-[4-(3-methyl-1-benzothiophen-2-yl)piperidin-1-yl]propan-2-ol; ethanedioic acid

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-4-yloxy)-3-[4-(3-methyl-1-benzothiophen-2-yl)piperidin-1-yl]propan-2-ol; ethanedioic acid Openeye Name: 1-(2,3-dihydrobenzofuran-4-yloxy)-3-[4-(3-methylbenzothiophen-2-yl)-1-piperidyl]propan-2-ol; oxalic acid CAS Name: 1-(2,3-dihydrobenzofuran-4-yloxy)-3-[4-(3-methyl-1-benzothiophen-2-yl)-1-piperidinyl]-2-propanol; oxalic acid IUPAC Name: 1-(2,3-dihydro-1-benzofuran-4-yloxy)-3-[4-(3-methyl-1-benzothiophen-2-yl)piperidin-1-yl]propan-2-ol; oxalic acid Traditional Name: 1-coumaran-4-yloxy-3-[4-(3-methylbenzothiophen-2-yl)piperidino]propan-2-ol; oxalic acid Formula: C27H31NO7S MolecularWeight: 513.60254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3CCN(CC3)CC(COC4=CC=CC5=C4CCO5)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3CCN(CC3)CC(COC4=CC=CC5=C4CCO5)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H29NO3S.C2H2O4/c1-17-20-5-2-3-8-24(20)30-25(17)18-9-12-26(13-10-18)15-19(27)16-29-23-7-4-6-22-21(23)11-14-28-22;3-1(4)2(5)6/h2-8,18-19,27H,9-16H2,1H3;(H,3,4)(H,5,6)