[2,5-bis(oxidanylidene)pyrrol-1-yl] 3-[5-(2-anthracen-9-ylethynyl)thiophen-2-yl]propanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrol-1-yl] 3-[5-(2-anthracen-9-ylethynyl)thiophen-2-yl]propanoate Openeye Name: (2,5-dioxopyrrol-1-yl) 3-[5-[2-(9-anthryl)ethynyl]-2-thienyl]propanoate CAS Name: 3-[5-[2-(9-anthracenyl)ethynyl]-2-thiophenyl]propanoic acid (2,5-dioxo-1-pyrrolyl) ester IUPAC Name: (2,5-dioxopyrrol-1-yl) 3-[5-(2-anthracen-9-ylethynyl)thiophen-2-yl]propanoate Traditional Name: 3-[5-[2-(9-anthryl)ethynyl]-2-thienyl]propionic acid maleimido ester Formula: C27H17NO4S MolecularWeight: 451.49318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C#CC4=CC=C(S4)CCC(=O)ON5C(=O)C=CC5=O

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C#CC4=CC=C(S4)CCC(=O)ON5C(=O)C=CC5=O

InChI

InChI=1S/C27H17NO4S/c29-25-14-15-26(30)28(25)32-27(31)16-12-21-10-9-20(33-21)11-13-24-22-7-3-1-5-18(22)17-19-6-2-4-8-23(19)24/h1-10,14-15,17H,12,16H2