N'-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-N-(pyridin-3-ylmethyl)ethanediamide

Systemtic Name: N'-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-N-(pyridin-3-ylmethyl)ethanediamide Openeye Name: N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-N-(3-pyridylmethyl)oxamide CAS Name: N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-N-(3-pyridinylmethyl)oxamide IUPAC Name: N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-N-(pyridin-3-ylmethyl)oxamide Traditional Name: N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-N-(3-pyridylmethyl)oxamide Formula: C16H13BrN4O4 MolecularWeight: 405.20282

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C(=O)NCC3=CN=CC=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/NC(=O)C(=O)NCC3=CN=CC=C3)Br

InChI

InChI=1S/C16H13BrN4O4/c17-12-5-14-13(24-9-25-14)4-11(12)8-20-21-16(23)15(22)19-7-10-2-1-3-18-6-10/h1-6,8H,7,9H2,(H,19,22)(H,21,23)/b20-8+