9-(cyclopenten-1-yl)-N-[(3-iodanylphenyl)methyl]purin-2-amine hydrochloride

Systemtic Name: 9-(cyclopenten-1-yl)-N-[(3-iodanylphenyl)methyl]purin-2-amine hydrochloride Openeye Name: 9-(cyclopenten-1-yl)-N-[(3-iodophenyl)methyl]purin-2-amine hydrochloride CAS Name: 9-(1-cyclopentenyl)-N-[(3-iodophenyl)methyl]-2-purinamine hydrochloride IUPAC Name: 9-(cyclopenten-1-yl)-N-[(3-iodophenyl)methyl]purin-2-amine hydrochloride Traditional Name: [9-(cyclopenten-1-yl)purin-2-yl]-(3-iodobenzyl)amine hydrochloride Formula: C17H17ClIN5 MolecularWeight: 453.70785

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C1)N2C=NC3=CN=C(N=C32)NCC4=CC(=CC=C4)I.Cl

Isomeric SMILES

C1CC=C(C1)N2C=NC3=CN=C(N=C32)NCC4=CC(=CC=C4)I.Cl

InChI

InChI=1S/C17H16IN5.ClH/c18-13-5-3-4-12(8-13)9-19-17-20-10-15-16(22-17)23(11-21-15)14-6-1-2-7-14;/h3-6,8,10-11H,1-2,7,9H2,(H,19,20,22);1H