3-(9-phenylpurin-6-yl)prop-2-yn-1-ol

Systemtic Name: 3-(9-phenylpurin-6-yl)prop-2-yn-1-ol Openeye Name: 3-(9-phenylpurin-6-yl)prop-2-yn-1-ol CAS Name: 3-(9-phenyl-6-purinyl)-2-propyn-1-ol IUPAC Name: 3-(9-phenylpurin-6-yl)prop-2-yn-1-ol Traditional Name: 3-(9-phenylpurin-6-yl)prop-2-yn-1-ol Formula: C14H10N4O MolecularWeight: 250.2554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC3=C(N=CN=C32)C#CCO

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC3=C(N=CN=C32)C#CCO

InChI

InChI=1S/C14H10N4O/c19-8-4-7-12-13-14(16-9-15-12)18(10-17-13)11-5-2-1-3-6-11/h1-3,5-6,9-10,19H,8H2