N'-[6-[(2,3-dimethylphenyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: N'-[6-[(2,3-dimethylphenyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: N'-[6-(2,3-dimethylanilino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: N'-[6-(2,3-dimethylanilino)-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: N'-[6-(2,3-dimethylanilino)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: N'-[6-(2,3-dimethylanilino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C19H17N7O5 MolecularWeight: 423.38218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C19H17N7O5/c1-11-5-3-8-15(12(11)2)22-17-16(26(30)31)18(21-10-20-17)23-24-19(27)13-6-4-7-14(9-13)25(28)29/h3-10H,1-2H3,(H,24,27)(H2,20,21,22,23)