diphenyltin(2+); 2-(7H-purin-6-yliminomethyl)phenolate

Systemtic Name: diphenyltin(2+); 2-(7H-purin-6-yliminomethyl)phenolate Openeye Name: diphenyltin(2+); 2-(7H-purin-6-yliminomethyl)phenolate CAS Name: diphenyltin(2+); 2-(7H-purin-6-yliminomethyl)phenolate IUPAC Name: diphenyltin(2+); 2-(7H-purin-6-yliminomethyl)phenolate Traditional Name: diphenyltin(2+); 2-(7H-purin-6-yliminomethyl)phenolate Formula: C36H26N10O2Sn MolecularWeight: 749.36744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2.C1=CC=C(C(=C1)C=NC2=NC=NC3=C2NC=N3)[O-].C1=CC=C(C(=C1)C=NC2=NC=NC3=C2NC=N3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2.C1=CC=C(C(=C1)C=NC2=NC=NC3=C2NC=N3)[O-].C1=CC=C(C(=C1)C=NC2=NC=NC3=C2NC=N3)[O-]

InChI

InChI=1S/2C12H9N5O.2C6H5.Sn/c2*18-9-4-2-1-3-8(9)5-13-11-10-12(15-6-14-10)17-7-16-11;2*1-2-4-6-5-3-1;/h2*1-7,18H,(H,14,15,16,17);2*1-5H;/q;;;;+2/p-2