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

Systemtic Name: N-[(E)-[5-(2-methoxy-4-nitro-phenyl)furan-2-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(E)-[5-(2-methoxy-4-nitro-phenyl)-2-furyl]methyleneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(E)-[5-(2-methoxy-4-nitrophenyl)-2-furanyl]methylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(E)-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(E)-[5-(2-methoxy-4-nitro-phenyl)-2-furyl]methyleneamino]-piperonylamide Formula: C20H15N3O7 MolecularWeight: 409.349

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C=NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)/C=N/NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H15N3O7/c1-27-18-9-13(23(25)26)3-5-15(18)16-7-4-14(30-16)10-21-22-20(24)12-2-6-17-19(8-12)29-11-28-17/h2-10H,11H2,1H3,(H,22,24)/b21-10+