N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-homopiperonyl-2-morpholino-5-nitro-benzamide Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O6/c24-20(21-6-5-14-1-4-18-19(11-14)29-13-28-18)16-12-15(23(25)26)2-3-17(16)22-7-9-27-10-8-22/h1-4,11-12H,5-10,13H2,(H,21,24)