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

Systemtic Name: methyl 4-[[5-nitro-6-[2-(3-nitrophenyl)carbonylhydrazinyl]pyrimidin-4-yl]amino]benzoate Openeye Name: methyl 4-[[5-nitro-6-[2-(3-nitrobenzoyl)hydrazino]pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[5-nitro-6-[[(3-nitrophenyl)-oxomethyl]hydrazo]-4-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-nitro-6-[2-(3-nitrobenzoyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[5-nitro-6-[N'-(3-nitrobenzoyl)hydrazino]pyrimidin-4-yl]amino]benzoic acid methyl ester Formula: C19H15N7O7 MolecularWeight: 453.3651

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15N7O7/c1-33-19(28)11-5-7-13(8-6-11)22-16-15(26(31)32)17(21-10-20-16)23-24-18(27)12-3-2-4-14(9-12)25(29)30/h2-10H,1H3,(H,24,27)(H2,20,21,22,23)