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

Systemtic Name: 2-ethoxyethyl (Z)-2-cyano-3-[(6-fluoranylpyridin-3-yl)methylamino]pent-2-enoate Openeye Name: 2-ethoxyethyl (Z)-2-cyano-3-[(6-fluoro-3-pyridyl)methylamino]pent-2-enoate CAS Name: (Z)-2-cyano-3-[(6-fluoro-3-pyridinyl)methylamino]-2-pentenoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (Z)-2-cyano-3-[(6-fluoropyridin-3-yl)methylamino]pent-2-enoate Traditional Name: (Z)-2-cyano-3-[(6-fluoro-3-pyridyl)methylamino]pent-2-enoic acid 2-ethoxyethyl ester Formula: C16H20FN3O3 MolecularWeight: 321.346703

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C#N)C(=O)OCCOCC)NCC1=CN=C(C=C1)F

Isomeric SMILES

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

InChI

InChI=1S/C16H20FN3O3/c1-3-14(19-10-12-5-6-15(17)20-11-12)13(9-18)16(21)23-8-7-22-4-2/h5-6,11,19H,3-4,7-8,10H2,1-2H3/b14-13-