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

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(pyridin-3-ylmethyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(3-pyridylmethyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(3-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(pyridin-3-ylmethyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(3-pyridylmethyl)acrylamide Formula: C17H13N3O3 MolecularWeight: 307.30342

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C#N)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C#N)/C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C17H13N3O3/c18-8-14(17(21)20-10-13-2-1-5-19-9-13)6-12-3-4-15-16(7-12)23-11-22-15/h1-7,9H,10-11H2,(H,20,21)/b14-6+