N'-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoyl]-4-nitro-benzohydrazide

Systemtic Name: N'-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoyl]-4-nitro-benzohydrazide Openeye Name: N'-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]-4-nitro-benzohydrazide CAS Name: N'-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-oxoethyl]-4-nitrobenzohydrazide IUPAC Name: N'-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]-4-nitrobenzohydrazide Traditional Name: N'-[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetyl]-4-nitro-benzohydrazide Formula: C16H15N7O6 MolecularWeight: 401.3336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N7O6/c1-20-13-12(15(26)21(2)16(20)27)22(8-17-13)7-11(24)18-19-14(25)9-3-5-10(6-4-9)23(28)29/h3-6,8H,7H2,1-2H3,(H,18,24)(H,19,25)