N-(1,3-benzodioxol-5-yl)-1-[2-(2-nitrophenoxy)ethanoyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2-nitrophenoxy)ethanoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2-nitrophenoxy)acetyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2-nitrophenoxy)-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2-nitrophenoxy)acetyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2-nitrophenoxy)acetyl]isonipecotamide Formula: C21H21N3O7 MolecularWeight: 427.40734

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O7/c25-20(12-29-17-4-2-1-3-16(17)24(27)28)23-9-7-14(8-10-23)21(26)22-15-5-6-18-19(11-15)31-13-30-18/h1-6,11,14H,7-10,12-13H2,(H,22,26)