[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl (E)-3-phenylprop-2-enoate

Systemtic Name: [1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl (E)-3-phenylprop-2-enoate Openeye Name: (1,3-dimethyl-2,6-dioxo-purin-7-yl)methyl (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid (1,3-dimethyl-2,6-dioxo-7-purinyl)methyl ester IUPAC Name: (1,3-dimethyl-2,6-dioxopurin-7-yl)methyl (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid (2,6-diketo-1,3-dimethyl-purin-7-yl)methyl ester Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)COC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)COC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H16N4O4/c1-19-15-14(16(23)20(2)17(19)24)21(10-18-15)11-25-13(22)9-8-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3/b9-8+