ethyl 1-[6-[4-chloranyl-2-[(dimethylhydrazinylidene)methyl]phenoxy]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[6-[4-chloranyl-2-[(dimethylhydrazinylidene)methyl]phenoxy]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-[4-chloro-2-[(dimethylhydrazono)methyl]phenoxy]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[6-[4-chloro-2-[(dimethylhydrazinylidene)methyl]phenoxy]-5-nitro-4-pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-[4-chloro-2-[(dimethylhydrazinylidene)methyl]phenoxy]-5-nitropyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[6-[4-chloro-2-[(dimethylhydrazono)methyl]phenoxy]-5-nitro-pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C21H25ClN6O5 MolecularWeight: 476.9134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)OC3=C(C=C(C=C3)Cl)C=NN(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)OC3=C(C=C(C=C3)Cl)C=NN(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25ClN6O5/c1-4-32-21(29)14-7-9-27(10-8-14)19-18(28(30)31)20(24-13-23-19)33-17-6-5-16(22)11-15(17)12-25-26(2)3/h5-6,11-14H,4,7-10H2,1-3H3