ethanedioic acid; 1-[4-(4-fluoranyl-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol

Systemtic Name: ethanedioic acid; 1-[4-(4-fluoranyl-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol Openeye Name: 1-[4-(4-fluorobenzothiophen-2-yl)-2-methyl-1-piperidyl]-3-(1H-indol-4-yloxy)propan-2-ol; oxalic acid CAS Name: 1-[4-(4-fluoro-1-benzothiophen-2-yl)-2-methyl-1-piperidinyl]-3-(1H-indol-4-yloxy)-2-propanol; oxalic acid IUPAC Name: 1-[4-(4-fluoro-1-benzothiophen-2-yl)-2-methylpiperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol; oxalic acid Traditional Name: 1-[4-(4-fluorobenzothiophen-2-yl)-2-methyl-piperidino]-3-(1H-indol-4-yloxy)propan-2-ol; oxalic acid Formula: C27H29FN2O6S MolecularWeight: 528.592363

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCN1CC(COC2=CC=CC3=C2C=CN3)O)C4=CC5=C(C=CC=C5S4)F.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CC(CCN1CC(COC2=CC=CC3=C2C=CN3)O)C4=CC5=C(C=CC=C5S4)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H27FN2O2S.C2H2O4/c1-16-12-17(25-13-20-21(26)4-2-7-24(20)31-25)9-11-28(16)14-18(29)15-30-23-6-3-5-22-19(23)8-10-27-22;3-1(4)2(5)6/h2-8,10,13,16-18,27,29H,9,11-12,14-15H2,1H3;(H,3,4)(H,5,6)