ethyl 4-[5-[(Z)-2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(Z)-2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(Z)-3-(allylamino)-2-cyano-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 4-[5-[(Z)-2-cyano-3-oxo-3-(prop-2-enylamino)prop-1-enyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(Z)-2-cyano-3-oxo-3-(prop-2-enylamino)prop-1-enyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(Z)-3-(allylamino)-2-cyano-3-keto-prop-1-enyl]-2-furyl]benzoic acid ethyl ester Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NCC=C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C(/C#N)\C(=O)NCC=C

InChI

InChI=1S/C20H18N2O4/c1-3-11-22-19(23)16(13-21)12-17-9-10-18(26-17)14-5-7-15(8-6-14)20(24)25-4-2/h3,5-10,12H,1,4,11H2,2H3,(H,22,23)/b16-12-