2-[4-[2-azanyl-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]propanoate

Systemtic Name: 2-[4-[2-azanyl-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]propanoate Openeye Name: 2-[4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]propanoate CAS Name: 2-[4-[2-amino-6-(cyclopropylamino)-9-purinyl]-1-cyclopent-2-enyl]propanoate IUPAC Name: 2-[4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]propanoate Traditional Name: 2-[4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]propionate Formula: C16H19N6O2- MolecularWeight: 327.36106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC(C=C1)N2C=NC3=C2N=C(N=C3NC4CC4)N)C(=O)[O-]

Isomeric SMILES

CC(C1CC(C=C1)N2C=NC3=C2N=C(N=C3NC4CC4)N)C(=O)[O-]

InChI

InChI=1S/C16H20N6O2/c1-8(15(23)24)9-2-5-11(6-9)22-7-18-12-13(19-10-3-4-10)20-16(17)21-14(12)22/h2,5,7-11H,3-4,6H2,1H3,(H,23,24)(H3,17,19,20,21)/p-1