N-[(E)-[5-(4-methyl-3-nitro-phenyl)furan-2-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(E)-[5-(4-methyl-3-nitro-phenyl)furan-2-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(E)-[5-(4-methyl-3-nitro-phenyl)-2-furyl]methyleneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(E)-[5-(4-methyl-3-nitrophenyl)-2-furanyl]methylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(E)-[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(E)-[5-(4-methyl-3-nitro-phenyl)-2-furyl]methyleneamino]-piperonylamide Formula: C20H15N3O6 MolecularWeight: 393.3496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C=NNC(=O)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)/C=N/NC(=O)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O6/c1-12-2-3-13(8-16(12)23(25)26)17-7-5-15(29-17)10-21-22-20(24)14-4-6-18-19(9-14)28-11-27-18/h2-10H,11H2,1H3,(H,22,24)/b21-10+