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

Systemtic Name: ethyl 3-[[5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate Openeye Name: ethyl 3-[[5-nitro-6-[2-(4-nitrophenyl)hydrazino]pyrimidin-4-yl]amino]benzoate CAS Name: 3-[[5-nitro-6-[(4-nitrophenyl)hydrazo]-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate Traditional Name: 3-[[5-nitro-6-[N'-(4-nitrophenyl)hydrazino]pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C19H17N7O6 MolecularWeight: 439.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)NNC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)NNC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H17N7O6/c1-2-32-19(27)12-4-3-5-14(10-12)22-17-16(26(30)31)18(21-11-20-17)24-23-13-6-8-15(9-7-13)25(28)29/h3-11,23H,2H2,1H3,(H2,20,21,22,24)