6-oxidanyl-7-[[4-(phenylmethyl)piperidin-1-yl]methyl]-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one

Systemtic Name: 6-oxidanyl-7-[[4-(phenylmethyl)piperidin-1-yl]methyl]-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one Openeye Name: 7-[(4-benzyl-1-piperidyl)methyl]-6-hydroxy-2-(3-pyridylmethylene)benzofuran-3-one CAS Name: 6-hydroxy-7-[[4-(phenylmethyl)-1-piperidinyl]methyl]-2-(3-pyridinylmethylidene)-3-benzofuranone IUPAC Name: 7-[(4-benzylpiperidin-1-yl)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one Traditional Name: 7-[(4-benzylpiperidino)methyl]-6-hydroxy-2-(3-pyridylmethylene)coumaran-3-one Formula: C27H26N2O3 MolecularWeight: 426.50694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC3=C(C=CC4=C3OC(=CC5=CN=CC=C5)C4=O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC3=C(C=CC4=C3OC(=CC5=CN=CC=C5)C4=O)O

InChI

InChI=1S/C27H26N2O3/c30-24-9-8-22-26(31)25(16-21-7-4-12-28-17-21)32-27(22)23(24)18-29-13-10-20(11-14-29)15-19-5-2-1-3-6-19/h1-9,12,16-17,20,30H,10-11,13-15,18H2