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[5-(4-acetamido-5-ethyl-2-oxidanylidene-pyrimidin-1-yl)-4-(4-chlorophenyl)carbonyloxy-oxolan-2-yl]methyl 4-chloranylbenzoate

[5-(4-acetamido-5-ethyl-2-oxidanylidene-pyrimidin-1-yl)-4-(4-chlorophenyl)carbonyloxy-oxolan-2-yl]methyl 4-chloranylbenzoate

Systemtic Name:[5-(4-acetamido-5-ethyl-2-oxidanylidene-pyrimidin-1-yl)-4-(4-chlorophenyl)carbonyloxy-oxolan-2-yl]methyl 4-chloranylbenzoate
Openeye Name:[5-(4-acetamido-5-ethyl-2-oxo-pyrimidin-1-yl)-4-(4-chlorobenzoyl)oxy-tetrahydrofuran-2-yl]methyl 4-chlorobenzoate
CAS Name:4-chlorobenzoic acid [5-(4-acetamido-5-ethyl-2-oxo-1-pyrimidinyl)-4-[(4-chlorophenyl)-oxomethoxy]-2-oxolanyl]methyl ester
IUPAC Name:[5-(4-acetamido-5-ethyl-2-oxopyrimidin-1-yl)-4-(4-chlorobenzoyl)oxyoxolan-2-yl]methyl 4-chlorobenzoate
Traditional Name:4-chlorobenzoic acid [5-(4-acetamido-5-ethyl-2-keto-pyrimidin-1-yl)-4-(4-chlorobenzoyl)oxy-tetrahydrofuran-2-yl]methyl ester
Formula: C27H25Cl2N3O7
MolecularWeight: 574.4093
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=O)N=C1NC(=O)C)C2C(CC(O2)COC(=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)Cl


Isomeric SMILES

CCC1=CN(C(=O)N=C1NC(=O)C)C2C(CC(O2)COC(=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)Cl


InChI

InChI=1S/C27H25Cl2N3O7/c1-3-16-13-32(27(36)31-23(16)30-15(2)33)24-22(39-26(35)18-6-10-20(29)11-7-18)12-21(38-24)14-37-25(34)17-4-8-19(28)9-5-17/h4-11,13,21-22,24H,3,12,14H2,1-2H3,(H,30,31,33,36)


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