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

Systemtic Name: ethyl 4-[5-[(E)-2-cyano-3-(2-methylfuran-3-yl)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-2-cyano-3-(2-methyl-3-furyl)-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-2-cyano-3-(2-methyl-3-furanyl)-3-oxoprop-1-enyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-2-cyano-3-(2-methylfuran-3-yl)-3-oxoprop-1-enyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-2-cyano-3-keto-3-(2-methyl-3-furyl)prop-1-enyl]-2-furyl]benzoic acid ethyl ester Formula: C22H17NO5 MolecularWeight: 375.37408

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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)C3=C(OC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C(=O)C3=C(OC=C3)C

InChI

InChI=1S/C22H17NO5/c1-3-26-22(25)16-6-4-15(5-7-16)20-9-8-18(28-20)12-17(13-23)21(24)19-10-11-27-14(19)2/h4-12H,3H2,1-2H3/b17-12+