N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-N-(pyridin-3-ylmethyl)ethanediamide

Systemtic Name: N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-N-(pyridin-3-ylmethyl)ethanediamide Openeye Name: N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-N-(3-pyridylmethyl)oxamide CAS Name: N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-N-(3-pyridinylmethyl)oxamide IUPAC Name: N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-N-(pyridin-3-ylmethyl)oxamide Traditional Name: N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-N-(3-pyridylmethyl)oxamide Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=NNC(=O)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)/C=N/NC(=O)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C17H16N4O4/c22-16(19-10-13-2-1-5-18-9-13)17(23)21-20-11-12-3-4-14-15(8-12)25-7-6-24-14/h1-5,8-9,11H,6-7,10H2,(H,19,22)(H,21,23)/b20-11+