[1-cyclopentyl-9-fluoranyl-1-methoxy-3-methyl-3-(triphenylmethyl)oxy-2H-purine-1,3-diium-6-ylidene]cyanamide

Systemtic Name: [1-cyclopentyl-9-fluoranyl-1-methoxy-3-methyl-3-(triphenylmethyl)oxy-2H-purine-1,3-diium-6-ylidene]cyanamide Openeye Name: (1-cyclopentyl-9-fluoro-1-methoxy-3-methyl-3-trityloxy-2H-purine-1,3-diium-6-ylidene)cyanamide CAS Name: [1-cyclopentyl-9-fluoro-1-methoxy-3-methyl-3-(triphenylmethyl)oxy-2H-purine-1,3-diium-6-ylidene]cyanamide IUPAC Name: (1-cyclopentyl-9-fluoro-1-methoxy-3-methyl-3-trityloxy-2H-purine-1,3-diium-6-ylidene)cyanamide Traditional Name: (1-cyclopentyl-9-fluoro-1-methoxy-3-methyl-3-trityloxy-2H-purine-1,3-diium-6-ylidene)cyanamide Formula: C32H33FN6O2+2 MolecularWeight: 552.641823

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C[N+](C(=NC#N)C2=C1N(C=N2)F)(C3CCCC3)OC)OC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C[N+]1(C[N+](C(=NC#N)C2=C1N(C=N2)F)(C3CCCC3)OC)OC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H33FN6O2/c1-38(24-39(40-2,28-20-12-13-21-28)30(35-22-34)29-31(38)37(33)23-36-29)41-32(25-14-6-3-7-15-25,26-16-8-4-9-17-26)27-18-10-5-11-19-27/h3-11,14-19,23,28H,12-13,20-21,24H2,1-2H3/q+2