(E)-N-(5-chloranyl-2-methoxy-phenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-(5-chloranyl-2-methoxy-phenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-methoxy-phenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-(5-chloro-2-methoxyphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-methoxyphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-methoxy-phenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C17H13ClN2O6 MolecularWeight: 376.74792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C17H13ClN2O6/c1-24-14-4-3-11(18)7-12(14)19-17(21)5-2-10-6-15-16(26-9-25-15)8-13(10)20(22)23/h2-8H,9H2,1H3,(H,19,21)/b5-2+