N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanamide Openeye Name: 2-(2-allyl-4-nitro-phenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-(4-nitro-2-prop-2-enylphenoxy)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-nitro-2-prop-2-enylphenoxy)acetamide Traditional Name: 2-(2-allyl-4-nitro-phenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide Formula: C20H19N3O7 MolecularWeight: 413.38076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC(=C1)[N+](=O)[O-])OCC(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C=CCC1=C(C=CC(=C1)[N+](=O)[O-])OCC(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H19N3O7/c1-2-3-13-10-15(23(26)27)5-7-16(13)30-12-19(24)22-20(25)21-14-4-6-17-18(11-14)29-9-8-28-17/h2,4-7,10-11H,1,3,8-9,12H2,(H2,21,22,24,25)