ethyl 2-[[5-nitro-6-[2-(3-nitrophenyl)carbonylhydrazinyl]pyrimidin-4-yl]amino]benzoate

Systemtic Name: ethyl 2-[[5-nitro-6-[2-(3-nitrophenyl)carbonylhydrazinyl]pyrimidin-4-yl]amino]benzoate Openeye Name: ethyl 2-[[5-nitro-6-[2-(3-nitrobenzoyl)hydrazino]pyrimidin-4-yl]amino]benzoate CAS Name: 2-[[5-nitro-6-[[(3-nitrophenyl)-oxomethyl]hydrazo]-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[5-nitro-6-[2-(3-nitrobenzoyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate Traditional Name: 2-[[5-nitro-6-[N'-(3-nitrobenzoyl)hydrazino]pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C20H17N7O7 MolecularWeight: 467.39168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H17N7O7/c1-2-34-20(29)14-8-3-4-9-15(14)23-17-16(27(32)33)18(22-11-21-17)24-25-19(28)12-6-5-7-13(10-12)26(30)31/h3-11H,2H2,1H3,(H,25,28)(H2,21,22,23,24)