[3-(4-chlorophenyl)carbonyloxy-5-(2-oxidanylidene-5-prop-1-ynyl-pyrimidin-1-yl)oxolan-2-yl]methyl 4-chloranylbenzoate

Systemtic Name: [3-(4-chlorophenyl)carbonyloxy-5-(2-oxidanylidene-5-prop-1-ynyl-pyrimidin-1-yl)oxolan-2-yl]methyl 4-chloranylbenzoate Openeye Name: [3-(4-chlorobenzoyl)oxy-5-(2-oxo-5-prop-1-ynyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [3-[(4-chlorophenyl)-oxomethoxy]-5-(2-oxo-5-prop-1-ynyl-1-pyrimidinyl)-2-oxolanyl]methyl ester IUPAC Name: [3-(4-chlorobenzoyl)oxy-5-(2-oxo-5-prop-1-ynylpyrimidin-1-yl)oxolan-2-yl]methyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [3-(4-chlorobenzoyl)oxy-5-(2-keto-5-prop-1-ynyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C26H20Cl2N2O6 MolecularWeight: 527.3528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CN(C(=O)N=C1)C2CC(C(O2)COC(=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC#CC1=CN(C(=O)N=C1)C2CC(C(O2)COC(=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H20Cl2N2O6/c1-2-3-16-13-29-26(33)30(14-16)23-12-21(36-25(32)18-6-10-20(28)11-7-18)22(35-23)15-34-24(31)17-4-8-19(27)9-5-17/h4-11,13-14,21-23H,12,15H2,1H3