[1-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]piperidin-4-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone

Systemtic Name: [1-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]piperidin-4-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone Openeye Name: [1-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-4-piperidyl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone CAS Name: [1-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-4-piperidinyl]-[4-(2-fluorophenyl)-1-piperazinyl]methanone IUPAC Name: [1-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]piperidin-4-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone Traditional Name: [1-(3,5-ditert-butyl-4-hydroxy-benzyl)-4-piperidyl]-[4-(2-fluorophenyl)piperazino]methanone Formula: C31H44FN3O2 MolecularWeight: 509.698363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C31H44FN3O2/c1-30(2,3)24-19-22(20-25(28(24)36)31(4,5)6)21-33-13-11-23(12-14-33)29(37)35-17-15-34(16-18-35)27-10-8-7-9-26(27)32/h7-10,19-20,23,36H,11-18,21H2,1-6H3