8-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-(5-methoxy-2-methyl-4-nitro-anilino)-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(5-methoxy-2-methyl-4-nitroanilino)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(5-methoxy-2-methyl-4-nitroanilino)-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-(5-methoxy-2-methyl-4-nitro-anilino)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C15H16N6O5 MolecularWeight: 360.32474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC2=NC3=C(N2)C(=O)N(C(=O)N3C)C)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC2=NC3=C(N2)C(=O)N(C(=O)N3C)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H16N6O5/c1-7-5-9(21(24)25)10(26-4)6-8(7)16-14-17-11-12(18-14)19(2)15(23)20(3)13(11)22/h5-6H,1-4H3,(H2,16,17,18)