N-[3-(dicyanomethylidene)-1-(2-methyl-1-octyl-indol-3-yl)-2H-isoindol-1-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[3-(dicyanomethylidene)-1-(2-methyl-1-octyl-indol-3-yl)-2H-isoindol-1-yl]-2,2-dimethyl-propanamide Openeye Name: N-[3-(dicyanomethylene)-1-(2-methyl-1-octyl-indol-3-yl)isoindolin-1-yl]-2,2-dimethyl-propanamide CAS Name: N-[3-(dicyanomethylidene)-1-(2-methyl-1-octyl-3-indolyl)-2H-isoindol-1-yl]-2,2-dimethylpropanamide IUPAC Name: N-[3-(dicyanomethylidene)-1-(2-methyl-1-octylindol-3-yl)-2H-isoindol-1-yl]-2,2-dimethylpropanamide Traditional Name: N-[3-(dicyanomethylene)-1-(2-methyl-1-octyl-indol-3-yl)isoindolin-1-yl]-2,2-dimethyl-propionamide Formula: C33H39N5O MolecularWeight: 521.69566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=C(C#N)C#N)N3)NC(=O)C(C)(C)C)C

Isomeric SMILES

CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=C(C#N)C#N)N3)NC(=O)C(C)(C)C)C

InChI

InChI=1S/C33H39N5O/c1-6-7-8-9-10-15-20-38-23(2)29(26-17-12-14-19-28(26)38)33(37-31(39)32(3,4)5)27-18-13-11-16-25(27)30(36-33)24(21-34)22-35/h11-14,16-19,36H,6-10,15,20H2,1-5H3,(H,37,39)