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

Systemtic Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(2-phenylsulfanylphenyl)prop-2-enamide Openeye Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(2-phenylsulfanylphenyl)prop-2-enamide CAS Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[2-(phenylthio)phenyl]-2-propenamide IUPAC Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(2-phenylsulfanylphenyl)prop-2-enamide Traditional Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[2-(phenylthio)phenyl]acrylamide Formula: C23H18N2O5S MolecularWeight: 434.46442

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=C/C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)OCO1

InChI

InChI=1S/C23H18N2O5S/c26-22(24-20-8-4-5-9-21(20)31-19-6-2-1-3-7-19)11-10-16-12-18(25(27)28)13-17-14-29-15-30-23(16)17/h1-13H,14-15H2,(H,24,26)/b11-10+