1-(6-chloranylpyridazin-3-yl)-N-(2-methoxy-5-nitro-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-(2-methoxy-5-nitro-phenyl)piperidine-3-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-(2-methoxy-5-nitro-phenyl)piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-(2-methoxy-5-nitrophenyl)-3-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-(2-methoxy-5-nitrophenyl)piperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-(2-methoxy-5-nitro-phenyl)nipecotamide Formula: C17H18ClN5O4 MolecularWeight: 391.80892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C17H18ClN5O4/c1-27-14-5-4-12(23(25)26)9-13(14)19-17(24)11-3-2-8-22(10-11)16-7-6-15(18)20-21-16/h4-7,9,11H,2-3,8,10H2,1H3,(H,19,24)