8-(3-chloranyl-4-phenethyloxy-phenyl)-7H-purin-6-amine

Systemtic Name: 8-(3-chloranyl-4-phenethyloxy-phenyl)-7H-purin-6-amine Openeye Name: 8-(3-chloro-4-phenethyloxy-phenyl)-7H-purin-6-amine CAS Name: 8-(3-chloro-4-phenethyloxyphenyl)-7H-purin-6-amine IUPAC Name: 8-(3-chloro-4-phenethyloxyphenyl)-7H-purin-6-amine Traditional Name: [8-(3-chloro-4-phenethyloxy-phenyl)-7H-purin-6-yl]amine Formula: C19H16ClN5O MolecularWeight: 365.81624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C3=NC4=C(N3)C(=NC=N4)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C3=NC4=C(N3)C(=NC=N4)N)Cl

InChI

InChI=1S/C19H16ClN5O/c20-14-10-13(18-24-16-17(21)22-11-23-19(16)25-18)6-7-15(14)26-9-8-12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H3,21,22,23,24,25)