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

Systemtic Name: ethanedioic acid; 1-[4-(6-methoxy-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-ol Openeye Name: 1-[4-(6-methoxybenzothiophen-2-yl)-2-methyl-1-piperidyl]-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-ol; oxalic acid CAS Name: 1-[4-(6-methoxy-1-benzothiophen-2-yl)-2-methyl-1-piperidinyl]-3-[(2-methyl-1H-indol-4-yl)oxy]-2-propanol; oxalic acid IUPAC Name: 1-[4-(6-methoxy-1-benzothiophen-2-yl)-2-methylpiperidin-1-yl]-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-ol; oxalic acid Traditional Name: 1-[4-(6-methoxybenzothiophen-2-yl)-2-methyl-piperidino]-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-ol; oxalic acid Formula: C29H34N2O7S MolecularWeight: 554.65446

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCN1CC(COC2=CC=CC3=C2C=C(N3)C)O)C4=CC5=C(S4)C=C(C=C5)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CC(CCN1CC(COC2=CC=CC3=C2C=C(N3)C)O)C4=CC5=C(S4)C=C(C=C5)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H32N2O3S.C2H2O4/c1-17-11-23-24(28-17)5-4-6-25(23)32-16-21(30)15-29-10-9-20(12-18(29)2)26-13-19-7-8-22(31-3)14-27(19)33-26;3-1(4)2(5)6/h4-8,11,13-14,18,20-21,28,30H,9-10,12,15-16H2,1-3H3;(H,3,4)(H,5,6)