1-(furan-2-ylmethyl)-3-(3-methylphenyl)-7H-purine-2,6-dione

Systemtic Name: 1-(furan-2-ylmethyl)-3-(3-methylphenyl)-7H-purine-2,6-dione Openeye Name: 1-(2-furylmethyl)-3-(m-tolyl)-7H-purine-2,6-dione CAS Name: 1-(2-furanylmethyl)-3-(3-methylphenyl)-7H-purine-2,6-dione IUPAC Name: 1-(furan-2-ylmethyl)-3-(3-methylphenyl)-7H-purine-2,6-dione Traditional Name: 1-(2-furfuryl)-3-(m-tolyl)-7H-purine-2,6-quinone Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=C(C(=O)N(C2=O)CC4=CC=CO4)NC=N3

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(C(=O)N(C2=O)CC4=CC=CO4)NC=N3

InChI

InChI=1S/C17H14N4O3/c1-11-4-2-5-12(8-11)21-15-14(18-10-19-15)16(22)20(17(21)23)9-13-6-3-7-24-13/h2-8,10H,9H2,1H3,(H,18,19)