[1-[1-(6-aminopurin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid

Systemtic Name: [1-[1-(6-aminopurin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid Openeye Name: [1-[1-(6-aminopurin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid CAS Name: [1-[1-(6-aminopurin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid IUPAC Name: [1-[1-(6-aminopurin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid Traditional Name: [1-(1-adenin-9-ylethyl)cyclopropyl]methoxymethylphosphonic acid Formula: C12H18N5O4P MolecularWeight: 327.276181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CC1)COCP(=O)(O)O)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

CC(C1(CC1)COCP(=O)(O)O)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C12H18N5O4P/c1-8(12(2-3-12)4-21-7-22(18,19)20)17-6-16-9-10(13)14-5-15-11(9)17/h5-6,8H,2-4,7H2,1H3,(H2,13,14,15)(H2,18,19,20)