1-(6-chloranyl-5-nitro-pyrimidin-4-yl)-N-(2-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(6-chloranyl-5-nitro-pyrimidin-4-yl)-N-(2-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-(6-chloro-5-nitro-pyrimidin-4-yl)-N-(2-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-(6-chloro-5-nitro-4-pyrimidinyl)-N-(2-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(6-chloro-5-nitropyrimidin-4-yl)-N-(2-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(6-chloro-5-nitro-pyrimidin-4-yl)-N-(2-methoxyphenyl)isonipecotamide Formula: C17H18ClN5O4 MolecularWeight: 391.80892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C3=C(C(=NC=N3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C3=C(C(=NC=N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H18ClN5O4/c1-27-13-5-3-2-4-12(13)21-17(24)11-6-8-22(9-7-11)16-14(23(25)26)15(18)19-10-20-16/h2-5,10-11H,6-9H2,1H3,(H,21,24)