N-[[5-(2-methylpyridin-4-yl)-1-benzofuran-7-yl]methyl]-2-phenyl-piperidin-3-amine trihydrochloride

Systemtic Name: N-[[5-(2-methylpyridin-4-yl)-1-benzofuran-7-yl]methyl]-2-phenyl-piperidin-3-amine trihydrochloride Openeye Name: N-[[5-(2-methyl-4-pyridyl)benzofuran-7-yl]methyl]-2-phenyl-piperidin-3-amine trihydrochloride CAS Name: N-[[5-(2-methyl-4-pyridinyl)-7-benzofuranyl]methyl]-2-phenyl-3-piperidinamine trihydrochloride IUPAC Name: N-[[5-(2-methylpyridin-4-yl)-1-benzofuran-7-yl]methyl]-2-phenylpiperidin-3-amine trihydrochloride Traditional Name: [5-(2-methyl-4-pyridyl)benzofuran-7-yl]methyl-(2-phenyl-3-piperidyl)amine trihydrochloride Formula: C26H30Cl3N3O MolecularWeight: 506.8949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=CC(=C3C(=C2)C=CO3)CNC4CCCNC4C5=CC=CC=C5.Cl.Cl.Cl

Isomeric SMILES

CC1=NC=CC(=C1)C2=CC(=C3C(=C2)C=CO3)CNC4CCCNC4C5=CC=CC=C5.Cl.Cl.Cl

InChI

InChI=1S/C26H27N3O.3ClH/c1-18-14-20(9-12-27-18)22-15-21-10-13-30-26(21)23(16-22)17-29-24-8-5-11-28-25(24)19-6-3-2-4-7-19;;;/h2-4,6-7,9-10,12-16,24-25,28-29H,5,8,11,17H2,1H3;3*1H