[1-(4-fluorophenyl)-1-oxidanylidene-4-(4-phenylpiperazin-1-yl)butan-2-yl] N-tert-butylcarbamate

Systemtic Name: [1-(4-fluorophenyl)-1-oxidanylidene-4-(4-phenylpiperazin-1-yl)butan-2-yl] N-tert-butylcarbamate Openeye Name: [1-(4-fluorobenzoyl)-3-(4-phenylpiperazin-1-yl)propyl] N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid [1-(4-fluorophenyl)-1-oxo-4-(4-phenyl-1-piperazinyl)butan-2-yl] ester IUPAC Name: [1-(4-fluorophenyl)-1-oxo-4-(4-phenylpiperazin-1-yl)butan-2-yl] N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid [1-(4-fluorobenzoyl)-3-(4-phenylpiperazino)propyl] ester Formula: C25H32FN3O3 MolecularWeight: 441.538283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)OC(CCN1CCN(CC1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)NC(=O)OC(CCN1CCN(CC1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C25H32FN3O3/c1-25(2,3)27-24(31)32-22(23(30)19-9-11-20(26)12-10-19)13-14-28-15-17-29(18-16-28)21-7-5-4-6-8-21/h4-12,22H,13-18H2,1-3H3,(H,27,31)