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

Systemtic Name: (E)-N-(6-chloranylpyridin-3-yl)sulfonyl-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Openeye Name: (E)-N-[(6-chloro-3-pyridyl)sulfonyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide CAS Name: (E)-N-[(6-chloro-3-pyridinyl)sulfonyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenamide IUPAC Name: (E)-N-(6-chloropyridin-3-yl)sulfonyl-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Traditional Name: (E)-N-[(6-chloro-3-pyridyl)sulfonyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylamide Formula: C16H12ClN3O7S MolecularWeight: 425.80038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClN3O7S/c17-14-3-2-13(7-18-14)28(24,25)19-15(21)4-1-10-5-12(20(22)23)6-11-8-26-9-27-16(10)11/h1-7H,8-9H2,(H,19,21)/b4-1+