N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-morpholino-5-nitro-benzamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-morpholino-5-nitro-benzamide Formula: C19H18BrN3O6 MolecularWeight: 464.26672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C19H18BrN3O6/c20-14-10-17-18(29-8-7-28-17)11-15(14)21-19(24)13-9-12(23(25)26)1-2-16(13)22-3-5-27-6-4-22/h1-2,9-11H,3-8H2,(H,21,24)