2-methoxyethyl (E)-2-cyano-3-[3,5-dimethyl-4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoate

Systemtic Name: 2-methoxyethyl (E)-2-cyano-3-[3,5-dimethyl-4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoate Openeye Name: 2-methoxyethyl (E)-2-cyano-3-[3,5-dimethyl-4-(2-pyridylmethoxy)phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3,5-dimethyl-4-(2-pyridinylmethoxy)phenyl]-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (E)-2-cyano-3-[3,5-dimethyl-4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[3,5-dimethyl-4-(2-pyridylmethoxy)phenyl]acrylic acid 2-methoxyethyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=CC=N2)C)C=C(C#N)C(=O)OCCOC

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=CC=N2)C)/C=C(\C#N)/C(=O)OCCOC

InChI

InChI=1S/C21H22N2O4/c1-15-10-17(12-18(13-22)21(24)26-9-8-25-3)11-16(2)20(15)27-14-19-6-4-5-7-23-19/h4-7,10-12H,8-9,14H2,1-3H3/b18-12+