tert-butyl 4-[2-(4-fluorophenyl)-4-methyl-piperazin-1-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-fluorophenyl)-4-methyl-piperazin-1-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-fluorophenyl)-4-methyl-piperazin-1-yl]piperidine-1-carboxylate CAS Name: 4-[2-(4-fluorophenyl)-4-methyl-1-piperazinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-fluorophenyl)-4-methylpiperazin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[2-(4-fluorophenyl)-4-methyl-piperazino]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H32FN3O2 MolecularWeight: 377.496083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2CCN(CC2C3=CC=C(C=C3)F)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2CCN(CC2C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H32FN3O2/c1-21(2,3)27-20(26)24-11-9-18(10-12-24)25-14-13-23(4)15-19(25)16-5-7-17(22)8-6-16/h5-8,18-19H,9-15H2,1-4H3