N-[(E)-[3,5-bis(iodanyl)-4-prop-2-ynoxy-phenyl]methylideneamino]-2-cyano-ethanamide

Systemtic Name: N-[(E)-[3,5-bis(iodanyl)-4-prop-2-ynoxy-phenyl]methylideneamino]-2-cyano-ethanamide Openeye Name: 2-cyano-N-[(E)-(3,5-diiodo-4-prop-2-ynoxy-phenyl)methyleneamino]acetamide CAS Name: 2-cyano-N-[(E)-(3,5-diiodo-4-prop-2-ynoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-cyano-N-[(E)-(3,5-diiodo-4-prop-2-ynoxyphenyl)methylideneamino]acetamide Traditional Name: 2-cyano-N-[(E)-(3,5-diiodo-4-propargyloxy-benzylidene)amino]acetamide Formula: C13H9I2N3O2 MolecularWeight: 493.0384

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C=C1I)C=NNC(=O)CC#N)I

Isomeric SMILES

C#CCOC1=C(C=C(C=C1I)/C=N/NC(=O)CC#N)I

InChI

InChI=1S/C13H9I2N3O2/c1-2-5-20-13-10(14)6-9(7-11(13)15)8-17-18-12(19)3-4-16/h1,6-8H,3,5H2,(H,18,19)/b17-8+