8-[(E)-bis(2-chloroethyl)aminodiazenyl]-5,9-dihydropurin-6-one

Systemtic Name: 8-[(E)-bis(2-chloroethyl)aminodiazenyl]-5,9-dihydropurin-6-one Openeye Name: 8-[(E)-bis(2-chloroethyl)aminoazo]-5,9-dihydropurin-6-one CAS Name: 8-[(E)-bis(2-chloroethyl)aminoazo]-5,9-dihydropurin-6-one IUPAC Name: 8-[(E)-bis(2-chloroethyl)aminodiazenyl]-5,9-dihydropurin-6-one Traditional Name: 8-[(E)-bis(2-chloroethyl)aminoazo]-5,9-dihydropurin-6-one Formula: C9H11Cl2N7O MolecularWeight: 304.13594

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2C(=N1)NC(=N2)N=NN(CCCl)CCCl

Isomeric SMILES

C1=NC(=O)C2C(=N1)NC(=N2)/N=N/N(CCCl)CCCl

InChI

InChI=1S/C9H11Cl2N7O/c10-1-3-18(4-2-11)17-16-9-14-6-7(15-9)12-5-13-8(6)19/h5-6H,1-4H2,(H,12,13,14,15,19)/b17-16+