2-phenoxyethyl (Z)-3-cyano-2-(4,6-dimethyl-1H-pyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate

Systemtic Name: 2-phenoxyethyl (Z)-3-cyano-2-(4,6-dimethyl-1H-pyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate Openeye Name: 2-phenoxyethyl (Z)-3-cyano-2-(4,6-dimethyl-1H-pyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate CAS Name: (Z)-3-cyano-2-(4,6-dimethyl-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-propenoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (Z)-3-cyano-2-(4,6-dimethyl-1H-pyrrolo[2,3-b]pyridin-2-yl)prop-2-enoate Traditional Name: (Z)-3-cyano-2-(4,6-dimethyl-1H-pyrrolo[2,3-b]pyridin-2-yl)acrylic acid 2-phenoxyethyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(N2)C(=CC#N)C(=O)OCCOC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(N2)/C(=C/C#N)/C(=O)OCCOC3=CC=CC=C3)C

InChI

InChI=1S/C21H19N3O3/c1-14-12-15(2)23-20-18(14)13-19(24-20)17(8-9-22)21(25)27-11-10-26-16-6-4-3-5-7-16/h3-8,12-13H,10-11H2,1-2H3,(H,23,24)/b17-8-