2-azanyl-6-chloranyl-9-octyl-7-prop-2-enyl-purin-8-one

Systemtic Name: 2-azanyl-6-chloranyl-9-octyl-7-prop-2-enyl-purin-8-one Openeye Name: 7-allyl-2-amino-6-chloro-9-octyl-purin-8-one CAS Name: 2-amino-6-chloro-9-octyl-7-prop-2-enyl-8-purinone IUPAC Name: 2-amino-6-chloro-9-octyl-7-prop-2-enylpurin-8-one Traditional Name: 7-allyl-2-amino-6-chloro-9-octyl-purin-8-one Formula: C16H24ClN5O MolecularWeight: 337.84766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C(=NC(=N2)N)Cl)N(C1=O)CC=C

Isomeric SMILES

CCCCCCCCN1C2=C(C(=NC(=N2)N)Cl)N(C1=O)CC=C

InChI

InChI=1S/C16H24ClN5O/c1-3-5-6-7-8-9-11-22-14-12(13(17)19-15(18)20-14)21(10-4-2)16(22)23/h4H,2-3,5-11H2,1H3,(H2,18,19,20)