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

Systemtic Name: (E)-N-(2-morpholin-4-yl-1-phenyl-ethyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Openeye Name: (E)-N-(2-morpholino-1-phenyl-ethyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide CAS Name: (E)-N-[2-(4-morpholinyl)-1-phenylethyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenamide IUPAC Name: (E)-N-(2-morpholin-4-yl-1-phenylethyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Traditional Name: (E)-N-(2-morpholino-1-phenyl-ethyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylamide Formula: C23H25N3O6 MolecularWeight: 439.4611

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC(C2=CC=CC=C2)NC(=O)C=CC3=CC(=CC4=C3OCOC4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CC(C2=CC=CC=C2)NC(=O)/C=C/C3=CC(=CC4=C3OCOC4)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O6/c27-22(7-6-18-12-20(26(28)29)13-19-15-31-16-32-23(18)19)24-21(17-4-2-1-3-5-17)14-25-8-10-30-11-9-25/h1-7,12-13,21H,8-11,14-16H2,(H,24,27)/b7-6+