[3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl 4-acetamidobenzoate

Systemtic Name: [3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl 4-acetamidobenzoate Openeye Name: [3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl 4-acetamidobenzoate CAS Name: 4-acetamidobenzoic acid [3-azido-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl ester IUPAC Name: [3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl 4-acetamidobenzoate Traditional Name: 4-acetamidobenzoic acid [3-azido-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C19H20N6O6 MolecularWeight: 428.3987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COC(=O)C3=CC=C(C=C3)NC(=O)C)N=[N+]=[N-]

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COC(=O)C3=CC=C(C=C3)NC(=O)C)N=[N+]=[N-]

InChI

InChI=1S/C19H20N6O6/c1-10-8-25(19(29)22-17(10)27)16-7-14(23-24-20)15(31-16)9-30-18(28)12-3-5-13(6-4-12)21-11(2)26/h3-6,8,14-16H,7,9H2,1-2H3,(H,21,26)(H,22,27,29)