(2Z)-7-bromanyl-1,3-dimethyl-2-[[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]hydrazinylidene]purin-6-one

Systemtic Name: (2Z)-7-bromanyl-1,3-dimethyl-2-[[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]hydrazinylidene]purin-6-one Openeye Name: (2Z)-7-bromo-1,3-dimethyl-2-[[2-(4-nitrophenyl)-2-oxo-ethyl]hydrazono]purin-6-one CAS Name: (2Z)-7-bromo-1,3-dimethyl-2-[[2-(4-nitrophenyl)-2-oxoethyl]hydrazinylidene]-6-purinone IUPAC Name: (2Z)-7-bromo-1,3-dimethyl-2-[[2-(4-nitrophenyl)-2-oxoethyl]hydrazinylidene]purin-6-one Traditional Name: (2Z)-7-bromo-2-[[2-keto-2-(4-nitrophenyl)ethyl]hydrazono]-1,3-dimethyl-purin-6-one Formula: C15H14BrN7O4 MolecularWeight: 436.22016

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=NNCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)N(C=N2)Br

Isomeric SMILES

CN\1C2=C(C(=O)N(/C1=N\NCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)N(C=N2)Br

InChI

InChI=1S/C15H14BrN7O4/c1-20-13-12(22(16)8-17-13)14(25)21(2)15(20)19-18-7-11(24)9-3-5-10(6-4-9)23(26)27/h3-6,8,18H,7H2,1-2H3/b19-15-