1-[4-(3,5-dimethoxy-4-oxidanyl-phenyl)carbonylpiperazin-1-yl]-6,6-bis(4-fluorophenyl)hexan-1-one

Systemtic Name: 1-[4-(3,5-dimethoxy-4-oxidanyl-phenyl)carbonylpiperazin-1-yl]-6,6-bis(4-fluorophenyl)hexan-1-one Openeye Name: 6,6-bis(4-fluorophenyl)-1-[4-(4-hydroxy-3,5-dimethoxy-benzoyl)piperazin-1-yl]hexan-1-one CAS Name: 6,6-bis(4-fluorophenyl)-1-[4-[(4-hydroxy-3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-1-hexanone IUPAC Name: 6,6-bis(4-fluorophenyl)-1-[4-(4-hydroxy-3,5-dimethoxybenzoyl)piperazin-1-yl]hexan-1-one Traditional Name: 6,6-bis(4-fluorophenyl)-1-(4-syringoylpiperazino)hexan-1-one Formula: C31H34F2N2O5 MolecularWeight: 552.608866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C(=O)N2CCN(CC2)C(=O)CCCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C(=O)N2CCN(CC2)C(=O)CCCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C31H34F2N2O5/c1-39-27-19-23(20-28(40-2)30(27)37)31(38)35-17-15-34(16-18-35)29(36)6-4-3-5-26(21-7-11-24(32)12-8-21)22-9-13-25(33)14-10-22/h7-14,19-20,26,37H,3-6,15-18H2,1-2H3