N-[1-(1-benzofuran-2-yl)ethyl]-1-(4-nitrophenyl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[1-(1-benzofuran-2-yl)ethyl]-1-(4-nitrophenyl)sulfonyl-piperidine-2-carboxamide Openeye Name: N-[1-(benzofuran-2-yl)ethyl]-1-(4-nitrophenyl)sulfonyl-piperidine-2-carboxamide CAS Name: N-[1-(2-benzofuranyl)ethyl]-1-(4-nitrophenyl)sulfonyl-2-piperidinecarboxamide IUPAC Name: N-[1-(1-benzofuran-2-yl)ethyl]-1-(4-nitrophenyl)sulfonylpiperidine-2-carboxamide Traditional Name: N-[1-(benzofuran-2-yl)ethyl]-1-nosyl-pipecolinamide Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3CCCCN3S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3CCCCN3S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O6S/c1-15(21-14-16-6-2-3-8-20(16)31-21)23-22(26)19-7-4-5-13-24(19)32(29,30)18-11-9-17(10-12-18)25(27)28/h2-3,6,8-12,14-15,19H,4-5,7,13H2,1H3,(H,23,26)