4-(4-tert-butylphenyl)-2-[[5-fluoranyl-2-(4-methylpiperazin-1-yl)phenyl]methyl]morpholin-3-one

Systemtic Name: 4-(4-tert-butylphenyl)-2-[[5-fluoranyl-2-(4-methylpiperazin-1-yl)phenyl]methyl]morpholin-3-one Openeye Name: 4-(4-tert-butylphenyl)-2-[[5-fluoro-2-(4-methylpiperazin-1-yl)phenyl]methyl]morpholin-3-one CAS Name: 4-(4-tert-butylphenyl)-2-[[5-fluoro-2-(4-methyl-1-piperazinyl)phenyl]methyl]-3-morpholinone IUPAC Name: 4-(4-tert-butylphenyl)-2-[[5-fluoro-2-(4-methylpiperazin-1-yl)phenyl]methyl]morpholin-3-one Traditional Name: 4-(4-tert-butylphenyl)-2-[5-fluoro-2-(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(=C3)F)N4CCN(CC4)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CCOC(C2=O)CC3=C(C=CC(=C3)F)N4CCN(CC4)C

InChI

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