N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-(2-thenoyl)nipecotamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H21N3O5S/c23-16(13-5-7-15(8-6-13)22(26)27)11-20-18(24)14-3-1-9-21(12-14)19(25)17-4-2-10-28-17/h2,4-8,10,14,16,23H,1,3,9,11-12H2,(H,20,24)