N-[(E)-(6-chloranyl-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-methyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[(E)-(6-chloranyl-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-methyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-methyl-2-nitro-phenoxy)acetamide CAS Name: N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-methyl-2-nitrophenoxy)acetamide IUPAC Name: N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-methyl-2-nitrophenoxy)acetamide Traditional Name: N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-methyl-2-nitro-phenoxy)acetamide Formula: C17H14ClN3O6 MolecularWeight: 391.76256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NN=CC2=CC3=C(C=C2Cl)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)N/N=C/C2=CC3=C(C=C2Cl)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O6/c1-10-2-3-14(13(4-10)21(23)24)25-8-17(22)20-19-7-11-5-15-16(6-12(11)18)27-9-26-15/h2-7H,8-9H2,1H3,(H,20,22)/b19-7+