2-(6-chloranyl-2-phenylazanyl-purin-7-yl)ethyl ethanoate

Systemtic Name: 2-(6-chloranyl-2-phenylazanyl-purin-7-yl)ethyl ethanoate Openeye Name: 2-(2-anilino-6-chloro-purin-7-yl)ethyl acetate CAS Name: acetic acid 2-(2-anilino-6-chloro-7-purinyl)ethyl ester IUPAC Name: 2-(2-anilino-6-chloropurin-7-yl)ethyl acetate Traditional Name: acetic acid 2-(2-anilino-6-chloro-purin-7-yl)ethyl ester Formula: C15H14ClN5O2 MolecularWeight: 331.75696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1C=NC2=C1C(=NC(=N2)NC3=CC=CC=C3)Cl

Isomeric SMILES

CC(=O)OCCN1C=NC2=C1C(=NC(=N2)NC3=CC=CC=C3)Cl

InChI

InChI=1S/C15H14ClN5O2/c1-10(22)23-8-7-21-9-17-14-12(21)13(16)19-15(20-14)18-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3,(H,18,19,20)