5-[[4-methyl-2-oxidanyl-4-phenyl-2-(pyridin-2-ylmethyl)pentyl]amino]-3H-2-benzofuran-1-one

Systemtic Name: 5-[[4-methyl-2-oxidanyl-4-phenyl-2-(pyridin-2-ylmethyl)pentyl]amino]-3H-2-benzofuran-1-one Openeye Name: 5-[[2-hydroxy-4-methyl-4-phenyl-2-(2-pyridylmethyl)pentyl]amino]-3H-isobenzofuran-1-one CAS Name: 5-[[2-hydroxy-4-methyl-4-phenyl-2-(2-pyridinylmethyl)pentyl]amino]-3H-isobenzofuran-1-one IUPAC Name: 5-[[2-hydroxy-4-methyl-4-phenyl-2-(pyridin-2-ylmethyl)pentyl]amino]-3H-2-benzofuran-1-one Traditional Name: 5-[[2-hydroxy-4-methyl-4-phenyl-2-(2-pyridylmethyl)pentyl]amino]phthalide Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CC1=CC=CC=N1)(CNC2=CC3=C(C=C2)C(=O)OC3)O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(CC(CC1=CC=CC=N1)(CNC2=CC3=C(C=C2)C(=O)OC3)O)C4=CC=CC=C4

InChI

InChI=1S/C26H28N2O3/c1-25(2,20-8-4-3-5-9-20)17-26(30,15-22-10-6-7-13-27-22)18-28-21-11-12-23-19(14-21)16-31-24(23)29/h3-14,28,30H,15-18H2,1-2H3