methyl 1-[6-[2-(2,4-dichlorophenyl)carbonylhydrazinyl]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[6-[2-(2,4-dichlorophenyl)carbonylhydrazinyl]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: methyl 1-[6-[2-(2,4-dichlorobenzoyl)hydrazino]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[6-[[(2,4-dichlorophenyl)-oxomethyl]hydrazo]-5-nitro-4-pyrimidinyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[6-[2-(2,4-dichlorobenzoyl)hydrazinyl]-5-nitropyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[6-[N'-(2,4-dichlorobenzoyl)hydrazino]-5-nitro-pyrimidin-4-yl]isonipecotic acid methyl ester Formula: C18H18Cl2N6O5 MolecularWeight: 469.27872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18Cl2N6O5/c1-31-18(28)10-4-6-25(7-5-10)16-14(26(29)30)15(21-9-22-16)23-24-17(27)12-3-2-11(19)8-13(12)20/h2-3,8-10H,4-7H2,1H3,(H,24,27)(H,21,22,23)