N-[2-oxidanylidene-2-[[3-(2-pyridin-2-ylethynyl)phenyl]amino]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[[3-(2-pyridin-2-ylethynyl)phenyl]amino]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-oxo-2-[3-[2-(2-pyridyl)ethynyl]anilino]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-oxo-2-[3-[2-(2-pyridinyl)ethynyl]anilino]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-oxo-2-[3-(2-pyridin-2-ylethynyl)anilino]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-keto-2-[3-[2-(2-pyridyl)ethynyl]anilino]ethyl]-piperonylamide Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

InChI

InChI=1S/C23H17N3O4/c27-22(14-25-23(28)17-8-10-20-21(13-17)30-15-29-20)26-19-6-3-4-16(12-19)7-9-18-5-1-2-11-24-18/h1-6,8,10-13H,14-15H2,(H,25,28)(H,26,27)