2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(4-benzyloxy-3-iodo-5-methoxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(4-benzoxy-3-iodo-5-methoxy-benzylidene)amino]acetamide Formula: C24H22IN3O5 MolecularWeight: 559.35305

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CNC2=CC3=C(C=C2)OCO3)I)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)CNC2=CC3=C(C=C2)OCO3)I)OCC4=CC=CC=C4

InChI

InChI=1S/C24H22IN3O5/c1-30-22-10-17(9-19(25)24(22)31-14-16-5-3-2-4-6-16)12-27-28-23(29)13-26-18-7-8-20-21(11-18)33-15-32-20/h2-12,26H,13-15H2,1H3,(H,28,29)/b27-12+