(3S)-1-[2-(4-nitrophenoxy)ethanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-(4-nitrophenoxy)ethanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[2-(4-nitrophenoxy)acetyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[2-(4-nitrophenoxy)-1-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-(4-nitrophenoxy)acetyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[2-(4-nitrophenoxy)acetyl]-N-phenyl-nipecotamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O5/c24-19(14-28-18-10-8-17(9-11-18)23(26)27)22-12-4-5-15(13-22)20(25)21-16-6-2-1-3-7-16/h1-3,6-11,15H,4-5,12-14H2,(H,21,25)/t15-/m0/s1