2-(3-phenylpropoxy)-9-prop-2-ynyl-purin-6-amine

Systemtic Name: 2-(3-phenylpropoxy)-9-prop-2-ynyl-purin-6-amine Openeye Name: 2-(3-phenylpropoxy)-9-prop-2-ynyl-purin-6-amine CAS Name: 2-(3-phenylpropoxy)-9-prop-2-ynyl-6-purinamine IUPAC Name: 2-(3-phenylpropoxy)-9-prop-2-ynylpurin-6-amine Traditional Name: [2-(3-phenylpropoxy)-9-propargyl-purin-6-yl]amine Formula: C17H17N5O MolecularWeight: 307.34978

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=NC2=C1N=C(N=C2N)OCCCC3=CC=CC=C3

Isomeric SMILES

C#CCN1C=NC2=C1N=C(N=C2N)OCCCC3=CC=CC=C3

InChI

InChI=1S/C17H17N5O/c1-2-10-22-12-19-14-15(18)20-17(21-16(14)22)23-11-6-9-13-7-4-3-5-8-13/h1,3-5,7-8,12H,6,9-11H2,(H2,18,20,21)