2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methyl]phenol CAS Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-[4-(2-fluorophenyl)-1-piperazinyl]methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methyl]phenol Traditional Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-[4-(2-fluorophenyl)piperazino]methyl]phenol Formula: C33H44FN3O MolecularWeight: 517.720363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C2=CC=C(C=C2)N(C)C)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C2=CC=C(C=C2)N(C)C)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C33H44FN3O/c1-32(2,3)26-21-24(22-27(31(26)38)33(4,5)6)30(23-13-15-25(16-14-23)35(7)8)37-19-17-36(18-20-37)29-12-10-9-11-28(29)34/h9-16,21-22,30,38H,17-20H2,1-8H3