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

Systemtic Name: ethanedioic acid; 1-[(2-methyl-1H-indol-4-yl)oxy]-3-[2-methyl-4-(4-methyl-1-benzothiophen-2-yl)piperidin-1-yl]propan-2-ol Openeye Name: 1-[(2-methyl-1H-indol-4-yl)oxy]-3-[2-methyl-4-(4-methylbenzothiophen-2-yl)-1-piperidyl]propan-2-ol; oxalic acid CAS Name: 1-[(2-methyl-1H-indol-4-yl)oxy]-3-[2-methyl-4-(4-methyl-1-benzothiophen-2-yl)-1-piperidinyl]-2-propanol; oxalic acid IUPAC Name: 1-[(2-methyl-1H-indol-4-yl)oxy]-3-[2-methyl-4-(4-methyl-1-benzothiophen-2-yl)piperidin-1-yl]propan-2-ol; oxalic acid Traditional Name: 1-[(2-methyl-1H-indol-4-yl)oxy]-3-[2-methyl-4-(4-methylbenzothiophen-2-yl)piperidino]propan-2-ol; oxalic acid Formula: C29H34N2O6S MolecularWeight: 538.65506

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCN1CC(COC2=CC=CC3=C2C=C(N3)C)O)C4=CC5=C(C=CC=C5S4)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CC(CCN1CC(COC2=CC=CC3=C2C=C(N3)C)O)C4=CC5=C(C=CC=C5S4)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H32N2O2S.C2H2O4/c1-17-6-4-9-26-22(17)14-27(32-26)20-10-11-29(19(3)13-20)15-21(30)16-31-25-8-5-7-24-23(25)12-18(2)28-24;3-1(4)2(5)6/h4-9,12,14,19-21,28,30H,10-11,13,15-16H2,1-3H3;(H,3,4)(H,5,6)