8-[(E)-bis(2-chloroethyl)aminodiazenyl]-5,9-dihydropurine-2,6-dione

Systemtic Name: 8-[(E)-bis(2-chloroethyl)aminodiazenyl]-5,9-dihydropurine-2,6-dione Openeye Name: 8-[(E)-bis(2-chloroethyl)aminoazo]-5,9-dihydropurine-2,6-dione CAS Name: 8-[(E)-bis(2-chloroethyl)aminoazo]-5,9-dihydropurine-2,6-dione IUPAC Name: 8-[(E)-bis(2-chloroethyl)aminodiazenyl]-5,9-dihydropurine-2,6-dione Traditional Name: 8-[(E)-bis(2-chloroethyl)aminoazo]-5,9-dihydropurine-2,6-quinone Formula: C9H11Cl2N7O2 MolecularWeight: 320.13534

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Descriptors Computed from Structure

Canonical SMILES:

C(CCl)N(CCCl)N=NC1=NC2C(=NC(=O)NC2=O)N1

Isomeric SMILES

C(CCl)N(CCCl)/N=N/C1=NC2C(=NC(=O)NC2=O)N1

InChI

InChI=1S/C9H11Cl2N7O2/c10-1-3-18(4-2-11)17-16-8-12-5-6(13-8)14-9(20)15-7(5)19/h5H,1-4H2,(H2,12,13,14,15,19,20)/b17-16+