N-[[6-methoxy-5-(2-methylpyrazol-3-yl)-1-benzofuran-7-yl]methyl]-2-phenyl-piperidin-3-amine

Systemtic Name: N-[[6-methoxy-5-(2-methylpyrazol-3-yl)-1-benzofuran-7-yl]methyl]-2-phenyl-piperidin-3-amine Openeye Name: N-[[6-methoxy-5-(2-methylpyrazol-3-yl)benzofuran-7-yl]methyl]-2-phenyl-piperidin-3-amine CAS Name: N-[[6-methoxy-5-(2-methyl-3-pyrazolyl)-7-benzofuranyl]methyl]-2-phenyl-3-piperidinamine IUPAC Name: N-[[6-methoxy-5-(2-methylpyrazol-3-yl)-1-benzofuran-7-yl]methyl]-2-phenylpiperidin-3-amine Traditional Name: [6-methoxy-5-(2-methylpyrazol-3-yl)benzofuran-7-yl]methyl-(2-phenyl-3-piperidyl)amine Formula: C25H28N4O2 MolecularWeight: 416.51542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C2=C(C(=C3C(=C2)C=CO3)CNC4CCCNC4C5=CC=CC=C5)OC

Isomeric SMILES

CN1C(=CC=N1)C2=C(C(=C3C(=C2)C=CO3)CNC4CCCNC4C5=CC=CC=C5)OC

InChI

InChI=1S/C25H28N4O2/c1-29-22(10-13-28-29)19-15-18-11-14-31-24(18)20(25(19)30-2)16-27-21-9-6-12-26-23(21)17-7-4-3-5-8-17/h3-5,7-8,10-11,13-15,21,23,26-27H,6,9,12,16H2,1-2H3