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

Systemtic Name: (E)-N-(3,3-diphenylpropyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Openeye Name: (E)-N-(3,3-diphenylpropyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide CAS Name: (E)-N-(3,3-diphenylpropyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenamide IUPAC Name: (E)-N-(3,3-diphenylpropyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Traditional Name: (E)-N-(3,3-diphenylpropyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylamide Formula: C26H24N2O5 MolecularWeight: 444.47916

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=CC(=O)NCCC(C3=CC=CC=C3)C4=CC=CC=C4)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=C/C(=O)NCCC(C3=CC=CC=C3)C4=CC=CC=C4)OCO1

InChI

InChI=1S/C26H24N2O5/c29-25(12-11-21-15-23(28(30)31)16-22-17-32-18-33-26(21)22)27-14-13-24(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-12,15-16,24H,13-14,17-18H2,(H,27,29)/b12-11+