[3,4-bis(phenylcarbonyloxy)-4-(2-phenyl-1,2,3-triazol-4-yl)butan-2-yl] benzoate

Systemtic Name: [3,4-bis(phenylcarbonyloxy)-4-(2-phenyl-1,2,3-triazol-4-yl)butan-2-yl] benzoate Openeye Name: [2,3-dibenzoyloxy-1-methyl-3-(2-phenyltriazol-4-yl)propyl] benzoate CAS Name: benzoic acid [3,4-dibenzoyloxy-4-(2-phenyl-4-triazolyl)butan-2-yl] ester IUPAC Name: [3,4-dibenzoyloxy-4-(2-phenyltriazol-4-yl)butan-2-yl] benzoate Traditional Name: benzoic acid [2,3-dibenzoyloxy-1-methyl-3-(2-phenyltriazol-4-yl)propyl] ester Formula: C33H27N3O6 MolecularWeight: 561.58398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C1=NN(N=C1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C(C(C1=NN(N=C1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C33H27N3O6/c1-23(40-31(37)24-14-6-2-7-15-24)29(41-32(38)25-16-8-3-9-17-25)30(42-33(39)26-18-10-4-11-19-26)28-22-34-36(35-28)27-20-12-5-13-21-27/h2-23,29-30H,1H3