dimethyl 3-(2-phenylethynyl)benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 3-(2-phenylethynyl)benzene-1,2-dicarboxylate Openeye Name: dimethyl 3-(2-phenylethynyl)benzene-1,2-dicarboxylate CAS Name: 3-(2-phenylethynyl)benzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(2-phenylethynyl)benzene-1,2-dicarboxylate Traditional Name: 3-(2-phenylethynyl)benzene-1,2-dicarboxylic acid dimethyl ester Formula: C18H14O4 MolecularWeight: 294.30136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1C(=O)OC)C#CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=CC(=C1C(=O)OC)C#CC2=CC=CC=C2

InChI

InChI=1S/C18H14O4/c1-21-17(19)15-10-6-9-14(16(15)18(20)22-2)12-11-13-7-4-3-5-8-13/h3-10H,1-2H3