2-[5-[3-(2-dimethylaminoethyl)-1-benzofuran-5-yl]pyridin-3-yl]-1-piperidin-1-yl-ethanone; ethanedioic acid

Systemtic Name: 2-[5-[3-(2-dimethylaminoethyl)-1-benzofuran-5-yl]pyridin-3-yl]-1-piperidin-1-yl-ethanone; ethanedioic acid Openeye Name: 2-[5-[3-(2-dimethylaminoethyl)benzofuran-5-yl]-3-pyridyl]-1-(1-piperidyl)ethanone; oxalic acid CAS Name: 2-[5-[3-(2-dimethylaminoethyl)-5-benzofuranyl]-3-pyridinyl]-1-(1-piperidinyl)ethanone; oxalic acid IUPAC Name: 2-[5-[3-(2-dimethylaminoethyl)-1-benzofuran-5-yl]pyridin-3-yl]-1-piperidin-1-ylethanone; oxalic acid Traditional Name: 2-[5-[3-(2-dimethylaminoethyl)benzofuran-5-yl]-3-pyridyl]-1-piperidino-ethanone; oxalic acid Formula: C26H31N3O6 MolecularWeight: 481.54084

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=COC2=C1C=C(C=C2)C3=CC(=CN=C3)CC(=O)N4CCCCC4.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CCC1=COC2=C1C=C(C=C2)C3=CC(=CN=C3)CC(=O)N4CCCCC4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H29N3O2.C2H2O4/c1-26(2)11-8-20-17-29-23-7-6-19(14-22(20)23)21-12-18(15-25-16-21)13-24(28)27-9-4-3-5-10-27;3-1(4)2(5)6/h6-7,12,14-17H,3-5,8-11,13H2,1-2H3;(H,3,4)(H,5,6)