ethyl 1-[5-nitro-6-[2-[2-(4-nitrophenyl)ethanoyl]hydrazinyl]pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-nitro-6-[2-[2-(4-nitrophenyl)ethanoyl]hydrazinyl]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-nitro-6-[2-[2-(4-nitrophenyl)acetyl]hydrazino]pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[5-nitro-6-[[2-(4-nitrophenyl)-1-oxoethyl]hydrazo]-4-pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-nitro-6-[2-[2-(4-nitrophenyl)acetyl]hydrazinyl]pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[5-nitro-6-[N'-[2-(4-nitrophenyl)acetyl]hydrazino]pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C20H23N7O7 MolecularWeight: 473.43932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)CC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)CC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H23N7O7/c1-2-34-20(29)14-7-9-25(10-8-14)19-17(27(32)33)18(21-12-22-19)24-23-16(28)11-13-3-5-15(6-4-13)26(30)31/h3-6,12,14H,2,7-11H2,1H3,(H,23,28)(H,21,22,24)