4-(4-tert-butylphenyl)-2-[[2-fluoranyl-6-(4-methylpiperazin-1-yl)phenyl]methyl]morpholin-3-one

Systemtic Name: 4-(4-tert-butylphenyl)-2-[[2-fluoranyl-6-(4-methylpiperazin-1-yl)phenyl]methyl]morpholin-3-one Openeye Name: 4-(4-tert-butylphenyl)-2-[[2-fluoro-6-(4-methylpiperazin-1-yl)phenyl]methyl]morpholin-3-one CAS Name: 4-(4-tert-butylphenyl)-2-[[2-fluoro-6-(4-methyl-1-piperazinyl)phenyl]methyl]-3-morpholinone IUPAC Name: 4-(4-tert-butylphenyl)-2-[[2-fluoro-6-(4-methylpiperazin-1-yl)phenyl]methyl]morpholin-3-one Traditional Name: 4-(4-tert-butylphenyl)-2-[2-fluoro-6-(4-methylpiperazino)benzyl]morpholin-3-one Formula: C26H34FN3O2 MolecularWeight: 439.565463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CCOC(C2=O)CC3=C(C=CC=C3F)N4CCN(CC4)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CCOC(C2=O)CC3=C(C=CC=C3F)N4CCN(CC4)C

InChI

InChI=1S/C26H34FN3O2/c1-26(2,3)19-8-10-20(11-9-19)30-16-17-32-24(25(30)31)18-21-22(27)6-5-7-23(21)29-14-12-28(4)13-15-29/h5-11,24H,12-18H2,1-4H3