(3S)-N-(4-nitrophenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-nitrophenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-(4-nitrophenyl)piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-(4-nitrophenyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-(4-nitrophenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-(4-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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c22-18(19-15-8-10-16(11-9-15)21(23)24)14-5-4-12-20(13-14)27(25,26)17-6-2-1-3-7-17/h1-3,6-11,14H,4-5,12-13H2,(H,19,22)/t14-/m0/s1