N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methyl-2-nitro-phenoxy)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methyl-2-nitro-phenoxy)acetamide CAS Name: N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-(4-methyl-2-nitrophenoxy)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methyl-2-nitrophenoxy)acetamide Traditional Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-methyl-2-nitro-phenoxy)acetamide Formula: C17H15N3O7 MolecularWeight: 373.3169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O7/c1-10-2-4-13(12(6-10)20(23)24)25-8-16(21)19-17(22)18-11-3-5-14-15(7-11)27-9-26-14/h2-7H,8-9H2,1H3,(H2,18,19,21,22)