2-(4-butan-2-ylphenoxy)-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]ethanamide

Systemtic Name: 2-(4-butan-2-ylphenoxy)-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]ethanamide Openeye Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-sec-butylphenoxy)acetamide CAS Name: 2-(4-butan-2-ylphenoxy)-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]acetamide IUPAC Name: 2-(4-butan-2-ylphenoxy)-N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]acetamide Traditional Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-sec-butylphenoxy)acetamide Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC(=O)N/N=C\C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C20H21N3O6/c1-3-13(2)14-4-6-16(7-5-14)27-11-20(24)22-21-10-15-8-18-19(29-12-28-18)9-17(15)23(25)26/h4-10,13H,3,11-12H2,1-2H3,(H,22,24)/b21-10-