(3-methylquinoxalin-2-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Openeye Name: (3-methylquinoxalin-2-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-propenoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)phenyl]acrylic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C=CC3=CC=C(C=C3)OCC#N

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)/C=C/C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C21H17N3O3/c1-15-20(24-19-5-3-2-4-18(19)23-15)14-27-21(25)11-8-16-6-9-17(10-7-16)26-13-12-22/h2-11H,13-14H2,1H3/b11-8+