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

Systemtic Name: 2-[2-[(E)-2-cyano-3-oxidanylidene-3-(4-propylphenyl)prop-1-enyl]phenoxy]ethanoate Openeye Name: 2-[2-[(E)-2-cyano-3-oxo-3-(4-propylphenyl)prop-1-enyl]phenoxy]acetate CAS Name: 2-[2-[(E)-2-cyano-3-oxo-3-(4-propylphenyl)prop-1-enyl]phenoxy]acetate IUPAC Name: 2-[2-[(E)-2-cyano-3-oxo-3-(4-propylphenyl)prop-1-enyl]phenoxy]acetate Traditional Name: 2-[2-[(E)-2-cyano-3-keto-3-(4-propylphenyl)prop-1-enyl]phenoxy]acetate Formula: C21H18NO4- MolecularWeight: 348.37192

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)C(=CC2=CC=CC=C2OCC(=O)[O-])C#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)/C(=C/C2=CC=CC=C2OCC(=O)[O-])/C#N

InChI

InChI=1S/C21H19NO4/c1-2-5-15-8-10-16(11-9-15)21(25)18(13-22)12-17-6-3-4-7-19(17)26-14-20(23)24/h3-4,6-12H,2,5,14H2,1H3,(H,23,24)/p-1/b18-12+