4-[2-azanyl-6-(cyclopropylamino)purin-9-yl]oxy-4-oxidanylidene-butanoate; cyclopent-2-en-1-ylmethanol

Systemtic Name: 4-[2-azanyl-6-(cyclopropylamino)purin-9-yl]oxy-4-oxidanylidene-butanoate; cyclopent-2-en-1-ylmethanol Openeye Name: 4-[2-amino-6-(cyclopropylamino)purin-9-yl]oxy-4-oxo-butanoate; cyclopent-2-en-1-ylmethanol CAS Name: 4-[[2-amino-6-(cyclopropylamino)-9-purinyl]oxy]-4-oxobutanoate; 1-cyclopent-2-enylmethanol IUPAC Name: 4-[2-amino-6-(cyclopropylamino)purin-9-yl]oxy-4-oxobutanoate; cyclopent-2-en-1-ylmethanol Traditional Name: 4-[2-amino-6-(cyclopropylamino)purin-9-yl]oxy-4-keto-butyrate; cyclopent-2-en-1-ylmethanol Formula: C18H23N6O5- MolecularWeight: 403.41242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C=C1)CO.C1CC1NC2=NC(=NC3=C2N=CN3OC(=O)CCC(=O)[O-])N

Isomeric SMILES

C1CC(C=C1)CO.C1CC1NC2=NC(=NC3=C2N=CN3OC(=O)CCC(=O)[O-])N

InChI

InChI=1S/C12H14N6O4.C6H10O/c13-12-16-10(15-6-1-2-6)9-11(17-12)18(5-14-9)22-8(21)4-3-7(19)20;7-5-6-3-1-2-4-6/h5-6H,1-4H2,(H,19,20)(H3,13,15,16,17);1,3,6-7H,2,4-5H2/p-1