ethyl 2-[4-[(E)-4-oxidanylidene-4-(pyridin-3-ylmethylamino)but-2-en-2-yl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[(E)-4-oxidanylidene-4-(pyridin-3-ylmethylamino)but-2-en-2-yl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[(E)-1-methyl-3-oxo-3-(3-pyridylmethylamino)prop-1-enyl]phenoxy]acetate CAS Name: 2-[4-[(E)-4-oxo-4-(3-pyridinylmethylamino)but-2-en-2-yl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(E)-4-oxo-4-(pyridin-3-ylmethylamino)but-2-en-2-yl]phenoxy]acetate Traditional Name: 2-[4-[(E)-3-keto-1-methyl-3-(3-pyridylmethylamino)prop-1-enyl]phenoxy]acetic acid ethyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4/c1-3-25-20(24)14-26-18-8-6-17(7-9-18)15(2)11-19(23)22-13-16-5-4-10-21-12-16/h4-12H,3,13-14H2,1-2H3,(H,22,23)/b15-11+