[3-methyl-1-(2-methyl-1,3-dioxolan-2-yl)-7-phenylmethoxy-hept-4-yn-3-yl] benzoate

Systemtic Name: [3-methyl-1-(2-methyl-1,3-dioxolan-2-yl)-7-phenylmethoxy-hept-4-yn-3-yl] benzoate Openeye Name: [5-benzyloxy-1-methyl-1-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pent-2-ynyl] benzoate CAS Name: benzoic acid [3-methyl-1-(2-methyl-1,3-dioxolan-2-yl)-7-phenylmethoxyhept-4-yn-3-yl] ester IUPAC Name: [3-methyl-1-(2-methyl-1,3-dioxolan-2-yl)-7-phenylmethoxyhept-4-yn-3-yl] benzoate Traditional Name: benzoic acid [5-benzoxy-1-methyl-1-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pent-2-ynyl] ester Formula: C26H30O5 MolecularWeight: 422.5134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)CCC(C)(C#CCCOCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1(OCCO1)CCC(C)(C#CCCOCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H30O5/c1-25(16-17-26(2)29-19-20-30-26,31-24(27)23-13-7-4-8-14-23)15-9-10-18-28-21-22-11-5-3-6-12-22/h3-8,11-14H,10,16-21H2,1-2H3