1,3-bis(cyclopropylmethyl)-8-nitro-7H-purine-2,6-dione

Systemtic Name: 1,3-bis(cyclopropylmethyl)-8-nitro-7H-purine-2,6-dione Openeye Name: 1,3-bis(cyclopropylmethyl)-8-nitro-7H-purine-2,6-dione CAS Name: 1,3-bis(cyclopropylmethyl)-8-nitro-7H-purine-2,6-dione IUPAC Name: 1,3-bis(cyclopropylmethyl)-8-nitro-7H-purine-2,6-dione Traditional Name: 1,3-bis(cyclopropylmethyl)-8-nitro-7H-purine-2,6-quinone Formula: C13H15N5O4 MolecularWeight: 305.2893

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C3=C(C(=O)N(C2=O)CC4CC4)NC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1CC1CN2C3=C(C(=O)N(C2=O)CC4CC4)NC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O4/c19-11-9-10(15-12(14-9)18(21)22)16(5-7-1-2-7)13(20)17(11)6-8-3-4-8/h7-8H,1-6H2,(H,14,15)