1-ethenyl-2-(3-fluorophenyl)-2-(9-methylpurin-2-yl)cyclopentan-1-ol hydrochloride

Systemtic Name: 1-ethenyl-2-(3-fluorophenyl)-2-(9-methylpurin-2-yl)cyclopentan-1-ol hydrochloride Openeye Name: 2-(3-fluorophenyl)-2-(9-methylpurin-2-yl)-1-vinyl-cyclopentanol hydrochloride CAS Name: 1-ethenyl-2-(3-fluorophenyl)-2-(9-methyl-2-purinyl)-1-cyclopentanol hydrochloride IUPAC Name: 1-ethenyl-2-(3-fluorophenyl)-2-(9-methylpurin-2-yl)cyclopentan-1-ol hydrochloride Traditional Name: 2-(3-fluorophenyl)-2-(9-methylpurin-2-yl)-1-vinyl-cyclopentanol hydrochloride Formula: C19H20ClFN4O MolecularWeight: 374.839703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=CN=C(N=C21)C3(CCCC3(C=C)O)C4=CC(=CC=C4)F.Cl

Isomeric SMILES

CN1C=NC2=CN=C(N=C21)C3(CCCC3(C=C)O)C4=CC(=CC=C4)F.Cl

InChI

InChI=1S/C19H19FN4O.ClH/c1-3-18(25)8-5-9-19(18,13-6-4-7-14(20)10-13)17-21-11-15-16(23-17)24(2)12-22-15;/h3-4,6-7,10-12,25H,1,5,8-9H2,2H3;1H