(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-pyridin-3-yl-prop-2-enamide

Systemtic Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(3-pyridyl)prop-2-enamide CAS Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-pyridin-3-ylprop-2-enamide Traditional Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(3-pyridyl)acrylamide Formula: C16H13N3O5 MolecularWeight: 327.29152

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=CC(=O)NC3=CN=CC=C3)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=C/C(=O)NC3=CN=CC=C3)OCO1

InChI

InChI=1S/C16H13N3O5/c20-15(18-13-2-1-5-17-8-13)4-3-11-6-14(19(21)22)7-12-9-23-10-24-16(11)12/h1-8H,9-10H2,(H,18,20)/b4-3+