ethyl 2-[[2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 2-[[2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]benzoate Openeye Name: ethyl 2-[[2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]benzoate CAS Name: 2-[[2-cyano-3-[1-(2-cyanoethyl)-3-indolyl]-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]benzoate Traditional Name: 2-[[2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]acryloyl]amino]benzoic acid ethyl ester Formula: C24H20N4O3 MolecularWeight: 412.4406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CN(C3=CC=CC=C32)CCC#N)C#N

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CN(C3=CC=CC=C32)CCC#N)C#N

InChI

InChI=1S/C24H20N4O3/c1-2-31-24(30)20-9-3-5-10-21(20)27-23(29)17(15-26)14-18-16-28(13-7-12-25)22-11-6-4-8-19(18)22/h3-6,8-11,14,16H,2,7,13H2,1H3,(H,27,29)