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

Systemtic Name: (E)-N-(6-methoxypyridin-3-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-(6-methoxy-3-pyridyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-(6-methoxy-3-pyridinyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-(6-methoxypyridin-3-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(6-methoxy-3-pyridyl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C16H13N3O6 MolecularWeight: 343.29092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O6/c1-23-16-5-3-11(8-17-16)18-15(20)4-2-10-6-13-14(25-9-24-13)7-12(10)19(21)22/h2-8H,9H2,1H3,(H,18,20)/b4-2+