2-azanyl-8-bromanyl-9-[[1-(cyclohexylmethoxy)-3-oxidanyl-propan-2-yl]oxymethyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-8-bromanyl-9-[[1-(cyclohexylmethoxy)-3-oxidanyl-propan-2-yl]oxymethyl]-3H-purin-6-one Openeye Name: 2-amino-8-bromo-9-[[1-(cyclohexylmethoxymethyl)-2-hydroxy-ethoxy]methyl]-3H-purin-6-one CAS Name: 2-amino-8-bromo-9-[[1-(cyclohexylmethoxy)-3-hydroxypropan-2-yl]oxymethyl]-3H-purin-6-one IUPAC Name: 2-amino-8-bromo-9-[[1-(cyclohexylmethoxy)-3-hydroxypropan-2-yl]oxymethyl]-3H-purin-6-one Traditional Name: 2-amino-8-bromo-9-[[1-(cyclohexylmethoxymethyl)-2-hydroxy-ethoxy]methyl]-3H-purin-6-one Formula: C16H24BrN5O4 MolecularWeight: 430.29686

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COCC(CO)OCN2C3=C(C(=O)N=C(N3)N)N=C2Br

Isomeric SMILES

C1CCC(CC1)COCC(CO)OCN2C3=C(C(=O)N=C(N3)N)N=C2Br

InChI

InChI=1S/C16H24BrN5O4/c17-15-19-12-13(20-16(18)21-14(12)24)22(15)9-26-11(6-23)8-25-7-10-4-2-1-3-5-10/h10-11,23H,1-9H2,(H3,18,20,21,24)