tert-butyl N-[[1-[2-(4-chloranylphenoxy)ethanoyl]-4-[(4-fluorophenyl)methyl]piperazin-2-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[1-[2-(4-chloranylphenoxy)ethanoyl]-4-[(4-fluorophenyl)methyl]piperazin-2-yl]methyl]carbamate Openeye Name: tert-butyl N-[[1-[2-(4-chlorophenoxy)acetyl]-4-[(4-fluorophenyl)methyl]piperazin-2-yl]methyl]carbamate CAS Name: N-[[1-[2-(4-chlorophenoxy)-1-oxoethyl]-4-[(4-fluorophenyl)methyl]-2-piperazinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[1-[2-(4-chlorophenoxy)acetyl]-4-[(4-fluorophenyl)methyl]piperazin-2-yl]methyl]carbamate Traditional Name: N-[[1-[2-(4-chlorophenoxy)acetyl]-4-(4-fluorobenzyl)piperazin-2-yl]methyl]carbamic acid tert-butyl ester Formula: C25H31ClFN3O4 MolecularWeight: 491.982743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1CN(CCN1C(=O)COC2=CC=C(C=C2)Cl)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)NCC1CN(CCN1C(=O)COC2=CC=C(C=C2)Cl)CC3=CC=C(C=C3)F

InChI

InChI=1S/C25H31ClFN3O4/c1-25(2,3)34-24(32)28-14-21-16-29(15-18-4-8-20(27)9-5-18)12-13-30(21)23(31)17-33-22-10-6-19(26)7-11-22/h4-11,21H,12-17H2,1-3H3,(H,28,32)