tert-butyl N-[[4-[4-(4-fluorophenyl)piperazin-1-yl]carbonylphenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[4-(4-fluorophenyl)piperazin-1-yl]carbonylphenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl]methyl]carbamate Traditional Name: N-[4-[4-(4-fluorophenyl)piperazine-1-carbonyl]benzyl]carbamic acid tert-butyl ester Formula: C23H28FN3O3 MolecularWeight: 413.485123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H28FN3O3/c1-23(2,3)30-22(29)25-16-17-4-6-18(7-5-17)21(28)27-14-12-26(13-15-27)20-10-8-19(24)9-11-20/h4-11H,12-16H2,1-3H3,(H,25,29)