ethanedioic acid; 4-[3-[2-(6-methoxy-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-2-oxidanyl-propoxy]-1H-indole-2-carboxamide

Systemtic Name: ethanedioic acid; 4-[3-[2-(6-methoxy-1-benzothiophen-2-yl)-2-methyl-piperidin-1-yl]-2-oxidanyl-propoxy]-1H-indole-2-carboxamide Openeye Name: 4-[2-hydroxy-3-[2-(6-methoxybenzothiophen-2-yl)-2-methyl-1-piperidyl]propoxy]-1H-indole-2-carboxamide; oxalic acid CAS Name: 4-[2-hydroxy-3-[2-(6-methoxy-1-benzothiophen-2-yl)-2-methyl-1-piperidinyl]propoxy]-1H-indole-2-carboxamide; oxalic acid IUPAC Name: 4-[2-hydroxy-3-[2-(6-methoxy-1-benzothiophen-2-yl)-2-methylpiperidin-1-yl]propoxy]-1H-indole-2-carboxamide; oxalic acid Traditional Name: 4-[2-hydroxy-3-[2-(6-methoxybenzothiophen-2-yl)-2-methyl-piperidino]propoxy]-1H-indole-2-carboxamide; oxalic acid Formula: C29H33N3O8S MolecularWeight: 583.65262

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCN1CC(COC2=CC=CC3=C2C=C(N3)C(=O)N)O)C4=CC5=C(S4)C=C(C=C5)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1(CCCCN1CC(COC2=CC=CC3=C2C=C(N3)C(=O)N)O)C4=CC5=C(S4)C=C(C=C5)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H31N3O4S.C2H2O4/c1-27(25-12-17-8-9-19(33-2)13-24(17)35-25)10-3-4-11-30(27)15-18(31)16-34-23-7-5-6-21-20(23)14-22(29-21)26(28)32;3-1(4)2(5)6/h5-9,12-14,18,29,31H,3-4,10-11,15-16H2,1-2H3,(H2,28,32);(H,3,4)(H,5,6)