N-[3-[(2-methoxy-5-nitro-phenyl)carbonylamino]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-[(2-methoxy-5-nitro-phenyl)carbonylamino]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-[(2-methoxy-5-nitro-benzoyl)amino]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[[(2-methoxy-5-nitrophenyl)-oxomethyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-[(2-methoxy-5-nitrobenzoyl)amino]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-[(2-methoxy-5-nitro-benzoyl)amino]phenyl]-piperonylamide Formula: C22H17N3O7 MolecularWeight: 435.38628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H17N3O7/c1-30-18-8-6-16(25(28)29)11-17(18)22(27)24-15-4-2-3-14(10-15)23-21(26)13-5-7-19-20(9-13)32-12-31-19/h2-11H,12H2,1H3,(H,23,26)(H,24,27)