ethyl 1-[5-chloranyl-3-[(5-chloranylpyridin-2-yl)carbamoyl]-2-nitro-phenyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-chloranyl-3-[(5-chloranylpyridin-2-yl)carbamoyl]-2-nitro-phenyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-chloro-3-[(5-chloro-2-pyridyl)carbamoyl]-2-nitro-phenyl]piperidine-4-carboxylate CAS Name: 1-[5-chloro-3-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-2-nitrophenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-chloro-3-[(5-chloropyridin-2-yl)carbamoyl]-2-nitrophenyl]piperidine-4-carboxylate Traditional Name: 1-[5-chloro-3-[(5-chloro-2-pyridyl)carbamoyl]-2-nitro-phenyl]isonipecotic acid ethyl ester Formula: C20H20Cl2N4O5 MolecularWeight: 467.3026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=CC(=C2)Cl)C(=O)NC3=NC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=CC(=C2)Cl)C(=O)NC3=NC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20Cl2N4O5/c1-2-31-20(28)12-5-7-25(8-6-12)16-10-14(22)9-15(18(16)26(29)30)19(27)24-17-4-3-13(21)11-23-17/h3-4,9-12H,2,5-8H2,1H3,(H,23,24,27)