ethanedioic acid; 1-[4-(5-fluoranyl-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol

Systemtic Name: ethanedioic acid; 1-[4-(5-fluoranyl-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol Openeye Name: 1-[4-(5-fluorobenzothiophen-2-yl)-2-methyl-1-piperidyl]-3-(1H-indol-4-yloxy)propan-2-ol; oxalic acid CAS Name: 1-[4-(5-fluoro-1-benzothiophen-2-yl)-2-methyl-1-piperidinyl]-3-(1H-indol-4-yloxy)-2-propanol; oxalic acid IUPAC Name: 1-[4-(5-fluoro-1-benzothiophen-2-yl)-2-methylpiperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol; oxalic acid Traditional Name: 1-[4-(5-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(S4)C=CC(=C5)F.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CC(CCN1CC(COC2=CC=CC3=C2C=CN3)O)C4=CC5=C(S4)C=CC(=C5)F.C(=O)(C(=O)O)O

InChI

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