3-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-5-methoxy-1H-indazole

Systemtic Name: 3-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-5-methoxy-1H-indazole Openeye Name: 3-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-5-methoxy-1H-indazole CAS Name: 3-[4-[4,4-bis(4-fluorophenyl)butyl]-1-piperazinyl]-5-methoxy-1H-indazole IUPAC Name: 3-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-5-methoxy-1H-indazole Traditional Name: 3-[4-[4,4-bis(4-fluorophenyl)butyl]piperazino]-5-methoxy-1H-indazole Formula: C28H30F2N4O MolecularWeight: 476.560806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NN=C2N3CCN(CC3)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC2=C(C=C1)NN=C2N3CCN(CC3)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H30F2N4O/c1-35-24-12-13-27-26(19-24)28(32-31-27)34-17-15-33(16-18-34)14-2-3-25(20-4-8-22(29)9-5-20)21-6-10-23(30)11-7-21/h4-13,19,25H,2-3,14-18H2,1H3,(H,31,32)