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

Systemtic Name: ethyl 3-[[6-[2-(furan-2-ylcarbonyl)hydrazinyl]-5-nitro-pyrimidin-4-yl]amino]benzoate Openeye Name: ethyl 3-[[6-[2-(furan-2-carbonyl)hydrazino]-5-nitro-pyrimidin-4-yl]amino]benzoate CAS Name: 3-[[6-[[2-furanyl(oxo)methyl]hydrazo]-5-nitro-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[6-[2-(furan-2-carbonyl)hydrazinyl]-5-nitropyrimidin-4-yl]amino]benzoate Traditional Name: 3-[[6-[N'-(2-furoyl)hydrazino]-5-nitro-pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C18H16N6O6 MolecularWeight: 412.35624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O6/c1-2-29-18(26)11-5-3-6-12(9-11)21-15-14(24(27)28)16(20-10-19-15)22-23-17(25)13-7-4-8-30-13/h3-10H,2H2,1H3,(H,23,25)(H2,19,20,21,22)