N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[2-(2-furyl)-2-(1-piperidyl)ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[2-(2-furyl)-2-piperidino-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3)C4=CC=CO4

Isomeric SMILES

C1CCN(CC1)C(CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3)C4=CC=CO4

InChI

InChI=1S/C20H23N3O6/c24-20(14-11-18-19(29-10-9-28-18)12-15(14)23(25)26)21-13-16(17-5-4-8-27-17)22-6-2-1-3-7-22/h4-5,8,11-12,16H,1-3,6-7,9-10,13H2,(H,21,24)