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

Systemtic Name: ethanedioic acid; 1-(1H-indol-4-yloxy)-3-[4-(4-methoxy-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]propan-2-ol Openeye Name: 1-(1H-indol-4-yloxy)-3-[4-(4-methoxybenzothiophen-2-yl)-2-methyl-1-piperidyl]propan-2-ol; oxalic acid CAS Name: 1-(1H-indol-4-yloxy)-3-[4-(4-methoxy-1-benzothiophen-2-yl)-2-methyl-1-piperidinyl]-2-propanol; oxalic acid IUPAC Name: 1-(1H-indol-4-yloxy)-3-[4-(4-methoxy-1-benzothiophen-2-yl)-2-methylpiperidin-1-yl]propan-2-ol; oxalic acid Traditional Name: 1-(1H-indol-4-yloxy)-3-[4-(4-methoxybenzothiophen-2-yl)-2-methyl-piperidino]propan-2-ol; oxalic acid Formula: C28H32N2O7S MolecularWeight: 540.62788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N2O3S.C2H2O4/c1-17-13-18(26-14-21-23(30-2)6-4-8-25(21)32-26)10-12-28(17)15-19(29)16-31-24-7-3-5-22-20(24)9-11-27-22;3-1(4)2(5)6/h3-9,11,14,17-19,27,29H,10,12-13,15-16H2,1-2H3;(H,3,4)(H,5,6)