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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1)C=CC=C2OCC(CN3CCC(CC3)C4=CC5=C(C=CC=C5S4)OC)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC2=C(N1)C=CC=C2OCC(CN3CCC(CC3)C4=CC5=C(C=CC=C5S4)OC)O.C(=O)(C(=O)O)O

InChI

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