methyl 2-[[[(Z)-4-(6-aminopurin-9-yl)but-2-enoxy]-phenoxy-phosphoryl]amino]propanoate

Systemtic Name: methyl 2-[[[(Z)-4-(6-aminopurin-9-yl)but-2-enoxy]-phenoxy-phosphoryl]amino]propanoate Openeye Name: methyl 2-[[[(Z)-4-(6-aminopurin-9-yl)but-2-enoxy]-phenoxy-phosphoryl]amino]propanoate CAS Name: 2-[[[(Z)-4-(6-aminopurin-9-yl)but-2-enoxy]-phenoxyphosphoryl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[[(Z)-4-(6-aminopurin-9-yl)but-2-enoxy]-phenoxyphosphoryl]amino]propanoate Traditional Name: 2-[[[(Z)-4-adenin-9-ylbut-2-enoxy]-phenoxy-phosphoryl]amino]propionic acid methyl ester Formula: C19H23N6O5P MolecularWeight: 446.396881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NP(=O)(OCC=CCN1C=NC2=C1N=CN=C2N)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OC)NP(=O)(OC/C=C\CN1C=NC2=C1N=CN=C2N)OC3=CC=CC=C3

InChI

InChI=1S/C19H23N6O5P/c1-14(19(26)28-2)24-31(27,30-15-8-4-3-5-9-15)29-11-7-6-10-25-13-23-16-17(20)21-12-22-18(16)25/h3-9,12-14H,10-11H2,1-2H3,(H,24,27)(H2,20,21,22)/b7-6-