N'-[2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]ethanoyl]-4-nitro-benzohydrazide

Systemtic Name: N'-[2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]ethanoyl]-4-nitro-benzohydrazide Openeye Name: N'-[2-(8-bromo-1,3-dimethyl-2,6-dioxo-purin-9-yl)acetyl]-4-nitro-benzohydrazide CAS Name: N'-[2-(8-bromo-1,3-dimethyl-2,6-dioxo-9-purinyl)-1-oxoethyl]-4-nitrobenzohydrazide IUPAC Name: N'-[2-(8-bromo-1,3-dimethyl-2,6-dioxopurin-9-yl)acetyl]-4-nitrobenzohydrazide Traditional Name: N'-[2-(8-bromo-2,6-diketo-1,3-dimethyl-purin-9-yl)acetyl]-4-nitro-benzohydrazide Formula: C16H14BrN7O6 MolecularWeight: 480.22966

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H14BrN7O6/c1-21-13-11(14(27)22(2)16(21)28)18-15(17)23(13)7-10(25)19-20-12(26)8-3-5-9(6-4-8)24(29)30/h3-6H,7H2,1-2H3,(H,19,25)(H,20,26)