N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-nitro-2-piperidino-benzamide Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H25N3O5/c26-22(23-9-8-16-4-7-20-21(14-16)30-13-12-29-20)18-15-17(25(27)28)5-6-19(18)24-10-2-1-3-11-24/h4-7,14-15H,1-3,8-13H2,(H,23,26)