[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(5-tert-butyl-2-methyl-furan-3-yl)methanone

Systemtic Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(5-tert-butyl-2-methyl-furan-3-yl)methanone Openeye Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(5-tert-butyl-2-methyl-3-furyl)methanone CAS Name: [4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-(5-tert-butyl-2-methyl-3-furanyl)methanone IUPAC Name: [4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-(5-tert-butyl-2-methylfuran-3-yl)methanone Traditional Name: [4-[bis(4-fluorophenyl)methyl]piperazino]-(5-tert-butyl-2-methyl-3-furyl)methanone Formula: C27H30F2N2O2 MolecularWeight: 452.536106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(C)(C)C)C(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(O1)C(C)(C)C)C(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H30F2N2O2/c1-18-23(17-24(33-18)27(2,3)4)26(32)31-15-13-30(14-16-31)25(19-5-9-21(28)10-6-19)20-7-11-22(29)12-8-20/h5-12,17,25H,13-16H2,1-4H3