hexyl 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: hexyl 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]benzoate Openeye Name: hexyl 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-1-piperazinyl]-2-oxoethoxy]benzoic acid hexyl ester IUPAC Name: hexyl 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-oxoethoxy]benzoate Traditional Name: 4-[2-[4-(4-fluorobenzyl)-2,5-dimethyl-piperazino]-2-keto-ethoxy]benzoic acid hexyl ester Formula: C28H37FN2O4 MolecularWeight: 484.602783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)OCC(=O)N2CC(N(CC2C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)OCC(=O)N2CC(N(CC2C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C28H37FN2O4/c1-4-5-6-7-16-34-28(33)24-10-14-26(15-11-24)35-20-27(32)31-18-21(2)30(17-22(31)3)19-23-8-12-25(29)13-9-23/h8-15,21-22H,4-7,16-20H2,1-3H3