N-(3-nitrophenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(3-nitrophenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(3-nitrophenyl)piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(3-nitrophenyl)-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(3-nitrophenyl)piperidine-3-carboxamide Traditional Name: 1-besyl-N-(3-nitrophenyl)nipecotamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c22-18(19-15-7-4-8-16(12-15)21(23)24)14-6-5-11-20(13-14)27(25,26)17-9-2-1-3-10-17/h1-4,7-10,12,14H,5-6,11,13H2,(H,19,22)