[4-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 2-iodanylethanoate

Systemtic Name: [4-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 2-iodanylethanoate Openeye Name: [4-(2,4-dioxopyrimidin-1-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 2-iodoacetate CAS Name: 2-iodoacetic acid [4-(2,4-dioxo-1-pyrimidinyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester IUPAC Name: [4-(2,4-dioxopyrimidin-1-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 2-iodoacetate Traditional Name: 2-iodoacetic acid [4-(2,4-diketopyrimidin-1-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester Formula: C14H17IN2O7 MolecularWeight: 452.19845

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(OC(C2O1)N3C=CC(=O)NC3=O)COC(=O)CI)C

Isomeric SMILES

CC1(OC2C(OC(C2O1)N3C=CC(=O)NC3=O)COC(=O)CI)C

InChI

InChI=1S/C14H17IN2O7/c1-14(2)23-10-7(6-21-9(19)5-15)22-12(11(10)24-14)17-4-3-8(18)16-13(17)20/h3-4,7,10-12H,5-6H2,1-2H3,(H,16,18,20)