4-chloranyl-3-nitro-N'-(5-nitro-6-phenylazanyl-pyrimidin-4-yl)benzohydrazide

Systemtic Name: 4-chloranyl-3-nitro-N'-(5-nitro-6-phenylazanyl-pyrimidin-4-yl)benzohydrazide Openeye Name: N'-(6-anilino-5-nitro-pyrimidin-4-yl)-4-chloro-3-nitro-benzohydrazide CAS Name: N'-(6-anilino-5-nitro-4-pyrimidinyl)-4-chloro-3-nitrobenzohydrazide IUPAC Name: N'-(6-anilino-5-nitropyrimidin-4-yl)-4-chloro-3-nitrobenzohydrazide Traditional Name: N'-(6-anilino-5-nitro-pyrimidin-4-yl)-4-chloro-3-nitro-benzohydrazide Formula: C17H12ClN7O5 MolecularWeight: 429.77408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H12ClN7O5/c18-12-7-6-10(8-13(12)24(27)28)17(26)23-22-16-14(25(29)30)15(19-9-20-16)21-11-4-2-1-3-5-11/h1-9H,(H,23,26)(H2,19,20,21,22)