N-[(E)-(6-chloranyl-1,3-benzodioxol-5-yl)methylideneamino]-2-(2-nitrophenoxy)propanamide

Systemtic Name: N-[(E)-(6-chloranyl-1,3-benzodioxol-5-yl)methylideneamino]-2-(2-nitrophenoxy)propanamide Openeye Name: N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methyleneamino]-2-(2-nitrophenoxy)propanamide CAS Name: N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-(2-nitrophenoxy)propanamide IUPAC Name: N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-(2-nitrophenoxy)propanamide Traditional Name: N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methyleneamino]-2-(2-nitrophenoxy)propionamide Formula: C17H14ClN3O6 MolecularWeight: 391.76256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=CC2=C(C=C1Cl)OCO2)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N/N=C/C1=CC2=C(C=C1Cl)OCO2)OC3=CC=CC=C3[N+](=O)[O-]

InChI

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