(E)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(2-pyridylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(2-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(2-pyridylmethyl)acrylamide Formula: C17H12N4O5 MolecularWeight: 352.30098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C(=O)NCC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=C(\C#N)/C(=O)NCC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O5/c18-8-12(17(22)20-9-13-3-1-2-4-19-13)5-11-6-15-16(26-10-25-15)7-14(11)21(23)24/h1-7H,9-10H2,(H,20,22)/b12-5+