2-azanyl-9-[2-[(6-methyl-2-oxidanylidene-4H-1,3,2$l^{5}-benzodioxaphosphinin-2-yl)oxy]ethoxymethyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[2-[(6-methyl-2-oxidanylidene-4H-1,3,2$l^{5}-benzodioxaphosphinin-2-yl)oxy]ethoxymethyl]-3H-purin-6-one Openeye Name: 2-amino-9-[2-[(6-methyl-2-oxo-4H-1,3,2$l^{5}-benzodioxaphosphinin-2-yl)oxy]ethoxymethyl]-3H-purin-6-one CAS Name: 2-amino-9-[2-[(6-methyl-2-oxo-4H-1,3,2$l^{5}-benzodioxaphosphorin-2-yl)oxy]ethoxymethyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[2-[(6-methyl-2-oxo-4H-1,3,2$l^{5}-benzodioxaphosphinin-2-yl)oxy]ethoxymethyl]-3H-purin-6-one Traditional Name: 2-amino-9-[2-[(2-keto-6-methyl-4H-1,3,2$l^{5}-benzodioxaphosphorin-2-yl)oxy]ethoxymethyl]-3H-purin-6-one Formula: C16H18N5O6P MolecularWeight: 407.317781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OP(=O)(OC2)OCCOCN3C=NC4=C3NC(=NC4=O)N

Isomeric SMILES

CC1=CC2=C(C=C1)OP(=O)(OC2)OCCOCN3C=NC4=C3NC(=NC4=O)N

InChI

InChI=1S/C16H18N5O6P/c1-10-2-3-12-11(6-10)7-26-28(23,27-12)25-5-4-24-9-21-8-18-13-14(21)19-16(17)20-15(13)22/h2-3,6,8H,4-5,7,9H2,1H3,(H3,17,19,20,22)