2-ethoxyethyl (Z)-2-cyano-3-[(6-fluoranylpyridin-3-yl)methylamino]-4-methyl-pent-2-enoate

Systemtic Name: 2-ethoxyethyl (Z)-2-cyano-3-[(6-fluoranylpyridin-3-yl)methylamino]-4-methyl-pent-2-enoate Openeye Name: 2-ethoxyethyl (Z)-2-cyano-3-[(6-fluoro-3-pyridyl)methylamino]-4-methyl-pent-2-enoate CAS Name: (Z)-2-cyano-3-[(6-fluoro-3-pyridinyl)methylamino]-4-methyl-2-pentenoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (Z)-2-cyano-3-[(6-fluoropyridin-3-yl)methylamino]-4-methylpent-2-enoate Traditional Name: (Z)-2-cyano-3-[(6-fluoro-3-pyridyl)methylamino]-4-methyl-pent-2-enoic acid 2-ethoxyethyl ester Formula: C17H22FN3O3 MolecularWeight: 335.373283

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C(=C(C(C)C)NCC1=CN=C(C=C1)F)C#N

Isomeric SMILES

CCOCCOC(=O)/C(=C(/C(C)C)\NCC1=CN=C(C=C1)F)/C#N

InChI

InChI=1S/C17H22FN3O3/c1-4-23-7-8-24-17(22)14(9-19)16(12(2)3)21-11-13-5-6-15(18)20-10-13/h5-6,10,12,21H,4,7-8,11H2,1-3H3/b16-14-