1-(5-chloranylthiophen-2-yl)sulfonyl-N-(2-methoxy-4-nitro-phenyl)piperidine-2-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(2-methoxy-4-nitro-phenyl)piperidine-2-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(2-methoxy-4-nitro-phenyl)piperidine-2-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(2-methoxy-4-nitrophenyl)-2-piperidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(2-methoxy-4-nitrophenyl)piperidine-2-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(2-methoxy-4-nitro-phenyl)pipecolinamide Formula: C17H18ClN3O6S2 MolecularWeight: 459.92432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H18ClN3O6S2/c1-27-14-10-11(21(23)24)5-6-12(14)19-17(22)13-4-2-3-9-20(13)29(25,26)16-8-7-15(18)28-16/h5-8,10,13H,2-4,9H2,1H3,(H,19,22)