N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(3,5-dinitrophenoxy)-N-ethyl-benzamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(3,5-dinitrophenoxy)-N-ethyl-benzamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-4-(3,5-dinitrophenoxy)-N-ethyl-benzamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(3,5-dinitrophenoxy)-N-ethylbenzamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(3,5-dinitrophenoxy)-N-ethylbenzamide Traditional Name: 4-(3,5-dinitrophenoxy)-N-ethyl-N-[(E)-piperonylideneamino]benzamide Formula: C23H18N4O8 MolecularWeight: 478.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])N=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(C(=O)C1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])/N=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H18N4O8/c1-2-25(24-13-15-3-8-21-22(9-15)34-14-33-21)23(28)16-4-6-19(7-5-16)35-20-11-17(26(29)30)10-18(12-20)27(31)32/h3-13H,2,14H2,1H3/b24-13+