1-(phenylmethyl)-3-prop-2-ynyl-purino[7,8-a]pyridine-2,4-dione

Systemtic Name: 1-(phenylmethyl)-3-prop-2-ynyl-purino[7,8-a]pyridine-2,4-dione Openeye Name: 1-benzyl-3-prop-2-ynyl-purino[7,8-a]pyridine-2,4-dione CAS Name: 1-(phenylmethyl)-3-prop-2-ynylpurino[7,8-a]pyridine-2,4-dione IUPAC Name: 1-benzyl-3-prop-2-ynylpurino[7,8-a]pyridine-2,4-dione Traditional Name: 1-benzyl-3-propargyl-purino[7,8-a]pyridine-2,4-quinone Formula: C19H14N4O2 MolecularWeight: 330.34006

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C2=C(N=C3N2C=CC=C3)N(C1=O)CC4=CC=CC=C4

Isomeric SMILES

C#CCN1C(=O)C2=C(N=C3N2C=CC=C3)N(C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C19H14N4O2/c1-2-11-22-18(24)16-17(20-15-10-6-7-12-21(15)16)23(19(22)25)13-14-8-4-3-5-9-14/h1,3-10,12H,11,13H2