N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-nitrophenyl)ethanamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-nitrophenyl)ethanamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-(4-nitrophenyl)acetamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-nitrophenyl)acetamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-nitrophenyl)acetamide Traditional Name: 2-(4-nitrophenyl)-N-[(E)-piperonylideneamino]acetamide Formula: C16H13N3O5 MolecularWeight: 327.29152

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O5/c20-16(8-11-1-4-13(5-2-11)19(21)22)18-17-9-12-3-6-14-15(7-12)24-10-23-14/h1-7,9H,8,10H2,(H,18,20)/b17-9+