9-[2-[[4-[2,3-bis(chloranyl)phenyl]-2-oxidanylidene-1,3,2$l^{5}-dioxaphosphinan-2-yl]methoxy]ethyl]purin-6-amine

Systemtic Name: 9-[2-[[4-[2,3-bis(chloranyl)phenyl]-2-oxidanylidene-1,3,2$l^{5}-dioxaphosphinan-2-yl]methoxy]ethyl]purin-6-amine Openeye Name: 9-[2-[[4-(2,3-dichlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphinan-2-yl]methoxy]ethyl]purin-6-amine CAS Name: 9-[2-[[4-(2,3-dichlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphorinan-2-yl]methoxy]ethyl]-6-purinamine IUPAC Name: 9-[2-[[4-(2,3-dichlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphinan-2-yl]methoxy]ethyl]purin-6-amine Traditional Name: [9-[2-[[4-(2,3-dichlorophenyl)-2-keto-1,3,2$l^{5}-dioxaphosphorinan-2-yl]methoxy]ethyl]purin-6-yl]amine Formula: C17H18Cl2N5O4P MolecularWeight: 458.235681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COP(=O)(OC1C2=C(C(=CC=C2)Cl)Cl)COCCN3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1COP(=O)(OC1C2=C(C(=CC=C2)Cl)Cl)COCCN3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C17H18Cl2N5O4P/c18-12-3-1-2-11(14(12)19)13-4-6-27-29(25,28-13)10-26-7-5-24-9-23-15-16(20)21-8-22-17(15)24/h1-3,8-9,13H,4-7,10H2,(H2,20,21,22)