1-[4-(3,5-ditert-butyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]-6,6-bis(4-fluorophenyl)hexan-1-one

Systemtic Name: 1-[4-(3,5-ditert-butyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]-6,6-bis(4-fluorophenyl)hexan-1-one Openeye Name: 1-[4-(3,5-ditert-butyl-4-methoxy-benzoyl)piperazin-1-yl]-6,6-bis(4-fluorophenyl)hexan-1-one CAS Name: 1-[4-[(3,5-ditert-butyl-4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-6,6-bis(4-fluorophenyl)-1-hexanone IUPAC Name: 1-[4-(3,5-ditert-butyl-4-methoxybenzoyl)piperazin-1-yl]-6,6-bis(4-fluorophenyl)hexan-1-one Traditional Name: 1-[4-(3,5-ditert-butyl-4-methoxy-benzoyl)piperazino]-6,6-bis(4-fluorophenyl)hexan-1-one Formula: C38H48F2N2O3 MolecularWeight: 618.796126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(=O)N2CCN(CC2)C(=O)CCCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(=O)N2CCN(CC2)C(=O)CCCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C38H48F2N2O3/c1-37(2,3)32-24-28(25-33(35(32)45-7)38(4,5)6)36(44)42-22-20-41(21-23-42)34(43)11-9-8-10-31(26-12-16-29(39)17-13-26)27-14-18-30(40)19-15-27/h12-19,24-25,31H,8-11,20-23H2,1-7H3