ethyl 2,4-bis(oxidanylidene)-4-[5-(2-phenylethynyl)thiophen-2-yl]butanoate

Systemtic Name: ethyl 2,4-bis(oxidanylidene)-4-[5-(2-phenylethynyl)thiophen-2-yl]butanoate Openeye Name: ethyl 2,4-dioxo-4-[5-(2-phenylethynyl)-2-thienyl]butanoate CAS Name: 2,4-dioxo-4-[5-(2-phenylethynyl)-2-thiophenyl]butanoic acid ethyl ester IUPAC Name: ethyl 2,4-dioxo-4-[5-(2-phenylethynyl)thiophen-2-yl]butanoate Traditional Name: 2,4-diketo-4-[5-(2-phenylethynyl)-2-thienyl]butyric acid ethyl ester Formula: C18H14O4S MolecularWeight: 326.36636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CC(=O)C1=CC=C(S1)C#CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(=O)CC(=O)C1=CC=C(S1)C#CC2=CC=CC=C2

InChI

InChI=1S/C18H14O4S/c1-2-22-18(21)16(20)12-15(19)17-11-10-14(23-17)9-8-13-6-4-3-5-7-13/h3-7,10-11H,2,12H2,1H3