[4-(2-phenylethynyl)phenyl] 4-(2-methyl-1,3-dioxolan-2-yl)butanoate

Systemtic Name: [4-(2-phenylethynyl)phenyl] 4-(2-methyl-1,3-dioxolan-2-yl)butanoate Openeye Name: [4-(2-phenylethynyl)phenyl] 4-(2-methyl-1,3-dioxolan-2-yl)butanoate CAS Name: 4-(2-methyl-1,3-dioxolan-2-yl)butanoic acid [4-(2-phenylethynyl)phenyl] ester IUPAC Name: [4-(2-phenylethynyl)phenyl] 4-(2-methyl-1,3-dioxolan-2-yl)butanoate Traditional Name: 4-(2-methyl-1,3-dioxolan-2-yl)butyric acid [4-(2-phenylethynyl)phenyl] ester Formula: C22H22O4 MolecularWeight: 350.40768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)CCCC(=O)OC2=CC=C(C=C2)C#CC3=CC=CC=C3

Isomeric SMILES

CC1(OCCO1)CCCC(=O)OC2=CC=C(C=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C22H22O4/c1-22(24-16-17-25-22)15-5-8-21(23)26-20-13-11-19(12-14-20)10-9-18-6-3-2-4-7-18/h2-4,6-7,11-14H,5,8,15-17H2,1H3