3-(2-azanyl-6-prop-2-enoxy-purin-9-yl)propanenitrile

Systemtic Name: 3-(2-azanyl-6-prop-2-enoxy-purin-9-yl)propanenitrile Openeye Name: 3-(6-allyloxy-2-amino-purin-9-yl)propanenitrile CAS Name: 3-(2-amino-6-prop-2-enoxy-9-purinyl)propanenitrile IUPAC Name: 3-(2-amino-6-prop-2-enoxypurin-9-yl)propanenitrile Traditional Name: 3-(6-allyloxy-2-amino-purin-9-yl)propionitrile Formula: C11H12N6O MolecularWeight: 244.25258

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=NC(=NC2=C1N=CN2CCC#N)N

Isomeric SMILES

C=CCOC1=NC(=NC2=C1N=CN2CCC#N)N

InChI

InChI=1S/C11H12N6O/c1-2-6-18-10-8-9(15-11(13)16-10)17(7-14-8)5-3-4-12/h2,7H,1,3,5-6H2,(H2,13,15,16)