2-[4-[(Z)-2-cyano-3-oxidanylidene-3-[[(2S)-oxolan-2-yl]methylamino]prop-1-enyl]-2-ethoxy-phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-2-cyano-3-oxidanylidene-3-[[(2S)-oxolan-2-yl]methylamino]prop-1-enyl]-2-ethoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-2-cyano-3-oxo-3-[[(2S)-tetrahydrofuran-2-yl]methylamino]prop-1-enyl]-2-ethoxy-phenoxy]acetate CAS Name: 2-[4-[(Z)-2-cyano-3-oxo-3-[[(2S)-2-oxolanyl]methylamino]prop-1-enyl]-2-ethoxyphenoxy]acetate IUPAC Name: 2-[4-[(Z)-2-cyano-3-oxo-3-[[(2S)-oxolan-2-yl]methylamino]prop-1-enyl]-2-ethoxyphenoxy]acetate Traditional Name: 2-[4-[(Z)-2-cyano-3-keto-3-[[(2S)-tetrahydrofuran-2-yl]methylamino]prop-1-enyl]-2-ethoxy-phenoxy]acetate Formula: C19H21N2O6- MolecularWeight: 373.37984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC2CCCO2)OCC(=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(/C#N)\C(=O)NC[C@@H]2CCCO2)OCC(=O)[O-]

InChI

InChI=1S/C19H22N2O6/c1-2-25-17-9-13(5-6-16(17)27-12-18(22)23)8-14(10-20)19(24)21-11-15-4-3-7-26-15/h5-6,8-9,15H,2-4,7,11-12H2,1H3,(H,21,24)(H,22,23)/p-1/b14-8-/t15-/m0/s1