N-[2-[(2-nitrophenyl)amino]ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[2-[(2-nitrophenyl)amino]ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-(2-nitroanilino)ethyl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-(2-nitroanilino)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-(2-nitroanilino)ethyl]piperidine-3-carboxamide Traditional Name: 1-besyl-N-[2-(2-nitroanilino)ethyl]nipecotamide Formula: C20H24N4O5S MolecularWeight: 432.49336

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5S/c25-20(22-13-12-21-18-10-4-5-11-19(18)24(26)27)16-7-6-14-23(15-16)30(28,29)17-8-2-1-3-9-17/h1-5,8-11,16,21H,6-7,12-15H2,(H,22,25)