2,2,4,6,7-pentamethyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-3H-1-benzofuran-5-ol

Systemtic Name: 2,2,4,6,7-pentamethyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-3H-1-benzofuran-5-ol Openeye Name: 2,2,4,6,7-pentamethyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-3H-benzofuran-5-ol CAS Name: 2,2,4,6,7-pentamethyl-3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-3H-benzofuran-5-ol IUPAC Name: 2,2,4,6,7-pentamethyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-3H-1-benzofuran-5-ol Traditional Name: 2,2,4,6,7-pentamethyl-3-[[4-(2-pyrimidyl)piperazino]methyl]coumaran-5-ol Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(C(OC2=C1C)(C)C)CN3CCN(CC3)C4=NC=CC=N4)C)O

Isomeric SMILES

CC1=C(C(=C2C(C(OC2=C1C)(C)C)CN3CCN(CC3)C4=NC=CC=N4)C)O

InChI

InChI=1S/C22H30N4O2/c1-14-15(2)20-18(16(3)19(14)27)17(22(4,5)28-20)13-25-9-11-26(12-10-25)21-23-7-6-8-24-21/h6-8,17,27H,9-13H2,1-5H3