6-chloranyl-9-[5-(phenylmethoxymethyl)-1,4-dioxan-2-yl]purin-2-amine

Systemtic Name: 6-chloranyl-9-[5-(phenylmethoxymethyl)-1,4-dioxan-2-yl]purin-2-amine Openeye Name: 9-[5-(benzyloxymethyl)-1,4-dioxan-2-yl]-6-chloro-purin-2-amine CAS Name: 6-chloro-9-[5-(phenylmethoxymethyl)-1,4-dioxan-2-yl]-2-purinamine IUPAC Name: 6-chloro-9-[5-(phenylmethoxymethyl)-1,4-dioxan-2-yl]purin-2-amine Traditional Name: [9-[5-(benzoxymethyl)-1,4-dioxan-2-yl]-6-chloro-purin-2-yl]amine Formula: C17H18ClN5O3 MolecularWeight: 375.80952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OCC(O1)N2C=NC3=C2N=C(N=C3Cl)N)COCC4=CC=CC=C4

Isomeric SMILES

C1C(OCC(O1)N2C=NC3=C2N=C(N=C3Cl)N)COCC4=CC=CC=C4

InChI

InChI=1S/C17H18ClN5O3/c18-15-14-16(22-17(19)21-15)23(10-20-14)13-9-25-12(8-26-13)7-24-6-11-4-2-1-3-5-11/h1-5,10,12-13H,6-9H2,(H2,19,21,22)