ethyl 2-[4-[(E)-2-cyano-3-oxidanylidene-3-(pyridin-3-ylmethylamino)prop-1-enyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[(E)-2-cyano-3-oxidanylidene-3-(pyridin-3-ylmethylamino)prop-1-enyl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[(E)-2-cyano-3-oxo-3-(3-pyridylmethylamino)prop-1-enyl]phenoxy]acetate CAS Name: 2-[4-[(E)-2-cyano-3-oxo-3-(3-pyridinylmethylamino)prop-1-enyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(E)-2-cyano-3-oxo-3-(pyridin-3-ylmethylamino)prop-1-enyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-2-cyano-3-keto-3-(3-pyridylmethylamino)prop-1-enyl]phenoxy]acetic acid ethyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)C=C(C#N)C(=O)NCC2=CN=CC=C2

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C20H19N3O4/c1-2-26-19(24)14-27-18-7-5-15(6-8-18)10-17(11-21)20(25)23-13-16-4-3-9-22-12-16/h3-10,12H,2,13-14H2,1H3,(H,23,25)/b17-10+