N-[(E)-[3-bromanyl-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(E)-[3-bromanyl-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(E)-[3-bromo-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methyleneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(E)-[3-bromo-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(E)-[3-bromo-5-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(E)-[3-bromo-5-methoxy-4-(4-nitrobenzyl)oxy-benzylidene]amino]-piperonylamide Formula: C23H18BrN3O7 MolecularWeight: 528.30892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)C2=CC3=C(C=C2)OCO3)Br)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)C2=CC3=C(C=C2)OCO3)Br)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18BrN3O7/c1-31-21-9-15(11-25-26-23(28)16-4-7-19-20(10-16)34-13-33-19)8-18(24)22(21)32-12-14-2-5-17(6-3-14)27(29)30/h2-11H,12-13H2,1H3,(H,26,28)/b25-11+