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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)Cl

Isomeric SMILES

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

InChI

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