(E)-2-cyano-N-(3-iodanylphenyl)-3-(5-phenylmethoxy-1H-indol-3-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-iodanylphenyl)-3-(5-phenylmethoxy-1H-indol-3-yl)prop-2-enamide Openeye Name: (E)-3-(5-benzyloxy-1H-indol-3-yl)-2-cyano-N-(3-iodophenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3-iodophenyl)-3-(5-phenylmethoxy-1H-indol-3-yl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-iodophenyl)-3-(5-phenylmethoxy-1H-indol-3-yl)prop-2-enamide Traditional Name: (E)-3-(5-benzoxy-1H-indol-3-yl)-2-cyano-N-(3-iodophenyl)acrylamide Formula: C25H18IN3O2 MolecularWeight: 519.33379

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3C=C(C#N)C(=O)NC4=CC(=CC=C4)I

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3/C=C(\C#N)/C(=O)NC4=CC(=CC=C4)I

InChI

InChI=1S/C25H18IN3O2/c26-20-7-4-8-21(12-20)29-25(30)18(14-27)11-19-15-28-24-10-9-22(13-23(19)24)31-16-17-5-2-1-3-6-17/h1-13,15,28H,16H2,(H,29,30)/b18-11+