2-cyclopentyl-8-[(4-nitrophenyl)methyl]-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one hydrochloride

Systemtic Name: 2-cyclopentyl-8-[(4-nitrophenyl)methyl]-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one hydrochloride Openeye Name: 2-cyclopentyl-8-[(4-nitrophenyl)methyl]-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one hydrochloride CAS Name: 2-cyclopentyl-8-[(4-nitrophenyl)methyl]-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one hydrochloride IUPAC Name: 2-cyclopentyl-8-[(4-nitrophenyl)methyl]-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one hydrochloride Traditional Name: 2-cyclopentyl-8-(4-nitrobenzyl)-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one hydrochloride Formula: C22H27ClN6O3 MolecularWeight: 458.94118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C3=NC(CN3C1=O)CC4=CC=C(C=C4)[N+](=O)[O-])NC(=N2)C5CCCC5.Cl

Isomeric SMILES

CCCN1C2=C(C3=NC(CN3C1=O)CC4=CC=C(C=C4)[N+](=O)[O-])NC(=N2)C5CCCC5.Cl

InChI

InChI=1S/C22H26N6O3.ClH/c1-2-11-26-21-18(24-19(25-21)15-5-3-4-6-15)20-23-16(13-27(20)22(26)29)12-14-7-9-17(10-8-14)28(30)31;/h7-10,15-16H,2-6,11-13H2,1H3,(H,24,25);1H