2-chloranyl-6-[4-(3-methoxyphenyl)piperazin-1-yl]-7H-purine

Systemtic Name: 2-chloranyl-6-[4-(3-methoxyphenyl)piperazin-1-yl]-7H-purine Openeye Name: 2-chloro-6-[4-(3-methoxyphenyl)piperazin-1-yl]-7H-purine CAS Name: 2-chloro-6-[4-(3-methoxyphenyl)-1-piperazinyl]-7H-purine IUPAC Name: 2-chloro-6-[4-(3-methoxyphenyl)piperazin-1-yl]-7H-purine Traditional Name: 2-chloro-6-[4-(3-methoxyphenyl)piperazino]-7H-purine Formula: C16H17ClN6O MolecularWeight: 344.79878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC(=NC4=C3NC=N4)Cl

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC(=NC4=C3NC=N4)Cl

InChI

InChI=1S/C16H17ClN6O/c1-24-12-4-2-3-11(9-12)22-5-7-23(8-6-22)15-13-14(19-10-18-13)20-16(17)21-15/h2-4,9-10H,5-8H2,1H3,(H,18,19,20,21)