[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl N-(2-nitrophenyl)carbonylsulfamate; N,N-diethylethanamine

Systemtic Name: [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl N-(2-nitrophenyl)carbonylsulfamate; N,N-diethylethanamine Openeye Name: [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl N-(2-nitrobenzoyl)sulfamate; N,N-diethylethanamine CAS Name: N,N-diethylethanamine; N-[(2-nitrophenyl)-oxomethyl]sulfamic acid [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester IUPAC Name: [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl N-(2-nitrobenzoyl)sulfamate; N,N-diethylethanamine Traditional Name: N-(2-nitrobenzoyl)sulfamic acid [(3aR,4R,6R,6aR)-4-adenin-9-yl-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester; triethylamine Formula: C26H36N8O9S MolecularWeight: 636.67724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1(OC2C(OC(C2O1)N3C=NC4=C3N=CN=C4N)COS(=O)(=O)NC(=O)C5=CC=CC=C5[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)CC.CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)N3C=NC4=C3N=CN=C4N)COS(=O)(=O)NC(=O)C5=CC=CC=C5[N+](=O)[O-])C

InChI

InChI=1S/C20H21N7O9S.C6H15N/c1-20(2)35-14-12(7-33-37(31,32)25-18(28)10-5-3-4-6-11(10)27(29)30)34-19(15(14)36-20)26-9-24-13-16(21)22-8-23-17(13)26;1-4-7(5-2)6-3/h3-6,8-9,12,14-15,19H,7H2,1-2H3,(H,25,28)(H2,21,22,23);4-6H2,1-3H3/t12-,14-,15-,19-;/m1./s1