sodium 3-phenyl-1-prop-2-enyl-purin-7-ide-2,6-dione

Systemtic Name: sodium 3-phenyl-1-prop-2-enyl-purin-7-ide-2,6-dione Openeye Name: sodium 1-allyl-3-phenyl-purin-7-ide-2,6-dione CAS Name: sodium 3-phenyl-1-prop-2-enylpurin-7-ide-2,6-dione IUPAC Name: sodium 3-phenyl-1-prop-2-enylpurin-7-ide-2,6-dione Traditional Name: sodium 1-allyl-3-phenyl-purin-7-ide-2,6-quinone Formula: C14H11N4NaO2 MolecularWeight: 290.25251

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C[N-]2)N(C1=O)C3=CC=CC=C3.[Na+]

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C[N-]2)N(C1=O)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C14H12N4O2.Na/c1-2-8-17-13(19)11-12(16-9-15-11)18(14(17)20)10-6-4-3-5-7-10;/h2-7,9H,1,8H2,(H,15,16,19);/q;+1/p-1