3-[3-[2-(1,3-benzodioxol-5-yl)-2-cyano-ethenyl]indol-1-yl]propanamide

Systemtic Name: 3-[3-[2-(1,3-benzodioxol-5-yl)-2-cyano-ethenyl]indol-1-yl]propanamide Openeye Name: 3-[3-[2-(1,3-benzodioxol-5-yl)-2-cyano-vinyl]indol-1-yl]propanamide CAS Name: 3-[3-[2-(1,3-benzodioxol-5-yl)-2-cyanoethenyl]-1-indolyl]propanamide IUPAC Name: 3-[3-[2-(1,3-benzodioxol-5-yl)-2-cyanoethenyl]indol-1-yl]propanamide Traditional Name: 3-[3-[2-(1,3-benzodioxol-5-yl)-2-cyano-vinyl]indol-1-yl]propionamide Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=CC3=CN(C4=CC=CC=C43)CCC(=O)N)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=CC3=CN(C4=CC=CC=C43)CCC(=O)N)C#N

InChI

InChI=1S/C21H17N3O3/c22-11-15(14-5-6-19-20(10-14)27-13-26-19)9-16-12-24(8-7-21(23)25)18-4-2-1-3-17(16)18/h1-6,9-10,12H,7-8,13H2,(H2,23,25)