2-[4-[(Z)-2-cyano-3-oxidanylidene-3-(3-phenylpropylamino)prop-1-enyl]-2-methoxy-phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-2-cyano-3-oxidanylidene-3-(3-phenylpropylamino)prop-1-enyl]-2-methoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-2-cyano-3-oxo-3-(3-phenylpropylamino)prop-1-enyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(Z)-2-cyano-3-oxo-3-(3-phenylpropylamino)prop-1-enyl]-2-methoxyphenoxy]acetate IUPAC Name: 2-[4-[(Z)-2-cyano-3-oxo-3-(3-phenylpropylamino)prop-1-enyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(Z)-2-cyano-3-keto-3-(3-phenylpropylamino)prop-1-enyl]-2-methoxy-phenoxy]acetate Formula: C22H21N2O5- MolecularWeight: 393.41254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NCCCC2=CC=CC=C2)OCC(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C#N)\C(=O)NCCCC2=CC=CC=C2)OCC(=O)[O-]

InChI

InChI=1S/C22H22N2O5/c1-28-20-13-17(9-10-19(20)29-15-21(25)26)12-18(14-23)22(27)24-11-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-10,12-13H,5,8,11,15H2,1H3,(H,24,27)(H,25,26)/p-1/b18-12-