2-cyano-N-(4-methoxyphenyl)-3-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)indol-3-yl]prop-2-enamide

Systemtic Name: 2-cyano-N-(4-methoxyphenyl)-3-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)indol-3-yl]prop-2-enamide Openeye Name: 3-[1-(2-anilino-2-oxo-ethyl)indol-3-yl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide CAS Name: 3-[1-(2-anilino-2-oxoethyl)-3-indolyl]-2-cyano-N-(4-methoxyphenyl)-2-propenamide IUPAC Name: 3-[1-(2-anilino-2-oxoethyl)indol-3-yl]-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Traditional Name: 3-[1-(2-anilino-2-keto-ethyl)indol-3-yl]-2-cyano-N-(4-methoxyphenyl)acrylamide Formula: C27H22N4O3 MolecularWeight: 450.48858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)NC4=CC=CC=C4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)NC4=CC=CC=C4)C#N

InChI

InChI=1S/C27H22N4O3/c1-34-23-13-11-22(12-14-23)30-27(33)19(16-28)15-20-17-31(25-10-6-5-9-24(20)25)18-26(32)29-21-7-3-2-4-8-21/h2-15,17H,18H2,1H3,(H,29,32)(H,30,33)