1-[4-(4,6-dimethyl-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol; ethanedioic acid

Systemtic Name: 1-[4-(4,6-dimethyl-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol; ethanedioic acid Openeye Name: 1-[4-(4,6-dimethylbenzothiophen-2-yl)-2-methyl-1-piperidyl]-3-(1H-indol-4-yloxy)propan-2-ol; oxalic acid CAS Name: 1-[4-(4,6-dimethyl-1-benzothiophen-2-yl)-2-methyl-1-piperidinyl]-3-(1H-indol-4-yloxy)-2-propanol; oxalic acid IUPAC Name: 1-[4-(4,6-dimethyl-1-benzothiophen-2-yl)-2-methylpiperidin-1-yl]-3-(1H-indol-4-yloxy)propan-2-ol; oxalic acid Traditional Name: 1-[4-(4,6-dimethylbenzothiophen-2-yl)-2-methyl-piperidino]-3-(1H-indol-4-yloxy)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=CN3)O)C4=CC5=C(C=C(C=C5S4)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

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

InChI

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