(E)-2-cyano-3-[2,5-dimethyl-1-(2-methylphenyl)pyrrol-3-yl]-N-(furan-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylphenyl)pyrrol-3-yl]-N-(furan-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[2,5-dimethyl-1-(o-tolyl)pyrrol-3-yl]-N-(2-furylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylphenyl)-3-pyrrolyl]-N-(2-furanylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylphenyl)pyrrol-3-yl]-N-(furan-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[2,5-dimethyl-1-(o-tolyl)pyrrol-3-yl]-N-(2-furfuryl)acrylamide Formula: C22H21N3O2 MolecularWeight: 359.42104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=C2C)C=C(C#N)C(=O)NCC3=CC=CO3)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=C2C)/C=C(\C#N)/C(=O)NCC3=CC=CO3)C

InChI

InChI=1S/C22H21N3O2/c1-15-7-4-5-9-21(15)25-16(2)11-18(17(25)3)12-19(13-23)22(26)24-14-20-8-6-10-27-20/h4-12H,14H2,1-3H3,(H,24,26)/b19-12+