1-[2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[N-(benzenesulfonyl)-3-nitro-anilino]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[N-(benzenesulfonyl)-3-nitroanilino]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[N-(benzenesulfonyl)-3-nitroanilino]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(N-besyl-3-nitro-anilino)acetyl]isonipecotamide Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O6S/c21-20(26)15-9-11-22(12-10-15)19(25)14-23(16-5-4-6-17(13-16)24(27)28)31(29,30)18-7-2-1-3-8-18/h1-8,13,15H,9-12,14H2,(H2,21,26)