9-[(4aR,6R,7R,7aS)-2-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-7-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-azanyl-3H-purin-6-one

Systemtic Name: 9-[(4aR,6R,7R,7aS)-2-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-7-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-azanyl-3H-purin-6-one Openeye Name: 9-[(4aR,6R,7R,7aS)-2-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-7-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one CAS Name: 9-[(4aR,6R,7R,7aS)-2-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-7-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-2-amino-3H-purin-6-one IUPAC Name: 9-[(4aR,6R,7R,7aS)-2-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-7-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one Traditional Name: 9-[(4aR,6R,7R,7aS)-2-(4,5-dimethoxy-2-nitro-benzyl)oxy-7-hydroxy-2-keto-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-2-amino-3H-purin-6-one Formula: C19H21N6O11P MolecularWeight: 540.377401

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COP2(=O)OCC3C(O2)C(C(O3)N4C=NC5=C4NC(=NC5=O)N)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COP2(=O)OC[C@@H]3[C@@H](O2)[C@H]([C@@H](O3)N4C=NC5=C4NC(=NC5=O)N)O)[N+](=O)[O-])OC

InChI

InChI=1S/C19H21N6O11P/c1-31-10-3-8(9(25(28)29)4-11(10)32-2)5-33-37(30)34-6-12-15(36-37)14(26)18(35-12)24-7-21-13-16(24)22-19(20)23-17(13)27/h3-4,7,12,14-15,18,26H,5-6H2,1-2H3,(H3,20,22,23,27)/t12-,14-,15-,18-,37?/m1/s1