(E)-N-(4-bromophenyl)-2-cyano-3-(5-phenylmethoxy-1H-indol-3-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-bromophenyl)-2-cyano-3-(5-phenylmethoxy-1H-indol-3-yl)prop-2-enamide Openeye Name: (E)-3-(5-benzyloxy-1H-indol-3-yl)-N-(4-bromophenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(4-bromophenyl)-2-cyano-3-(5-phenylmethoxy-1H-indol-3-yl)-2-propenamide IUPAC Name: (E)-N-(4-bromophenyl)-2-cyano-3-(5-phenylmethoxy-1H-indol-3-yl)prop-2-enamide Traditional Name: (E)-3-(5-benzoxy-1H-indol-3-yl)-N-(4-bromophenyl)-2-cyano-acrylamide Formula: C25H18BrN3O2 MolecularWeight: 472.33332

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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=C(C=C4)Br

Isomeric SMILES

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

InChI

InChI=1S/C25H18BrN3O2/c26-20-6-8-21(9-7-20)29-25(30)18(14-27)12-19-15-28-24-11-10-22(13-23(19)24)31-16-17-4-2-1-3-5-17/h1-13,15,28H,16H2,(H,29,30)/b18-12+