(E)-N-(4-bromophenyl)-2-cyano-3-(1-prop-2-ynylindol-3-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-bromophenyl)-2-cyano-3-(1-prop-2-ynylindol-3-yl)prop-2-enamide Openeye Name: (E)-N-(4-bromophenyl)-2-cyano-3-(1-prop-2-ynylindol-3-yl)prop-2-enamide CAS Name: (E)-N-(4-bromophenyl)-2-cyano-3-(1-prop-2-ynyl-3-indolyl)-2-propenamide IUPAC Name: (E)-N-(4-bromophenyl)-2-cyano-3-(1-prop-2-ynylindol-3-yl)prop-2-enamide Traditional Name: (E)-N-(4-bromophenyl)-2-cyano-3-(1-propargylindol-3-yl)acrylamide Formula: C21H14BrN3O MolecularWeight: 404.25936

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=C(C2=CC=CC=C21)C=C(C#N)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C#CCN1C=C(C2=CC=CC=C21)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H14BrN3O/c1-2-11-25-14-16(19-5-3-4-6-20(19)25)12-15(13-23)21(26)24-18-9-7-17(22)8-10-18/h1,3-10,12,14H,11H2,(H,24,26)/b15-12+