tert-butyl N-[3-[4-(4-fluorophenyl)piperazin-1-yl]carbonylphenyl]carbamate

Systemtic Name: tert-butyl N-[3-[4-(4-fluorophenyl)piperazin-1-yl]carbonylphenyl]carbamate Openeye Name: tert-butyl N-[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl]carbamate CAS Name: N-[3-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl]carbamate Traditional Name: N-[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl]carbamic acid tert-butyl ester Formula: C22H26FN3O3 MolecularWeight: 399.458543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O3/c1-22(2,3)29-21(28)24-18-6-4-5-16(15-18)20(27)26-13-11-25(12-14-26)19-9-7-17(23)8-10-19/h4-10,15H,11-14H2,1-3H3,(H,24,28)