6-chloranyl-9-(cyclopenta-2,4-dien-1-ylmethyl)purin-2-amine

Systemtic Name: 6-chloranyl-9-(cyclopenta-2,4-dien-1-ylmethyl)purin-2-amine Openeye Name: 6-chloro-9-(cyclopenta-2,4-dien-1-ylmethyl)purin-2-amine CAS Name: 6-chloro-9-(1-cyclopenta-2,4-dienylmethyl)-2-purinamine IUPAC Name: 6-chloro-9-(cyclopenta-2,4-dien-1-ylmethyl)purin-2-amine Traditional Name: [6-chloro-9-(cyclopenta-2,4-dien-1-ylmethyl)purin-2-yl]amine Formula: C11H10ClN5 MolecularWeight: 247.6836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C=C1)CN2C=NC3=C2N=C(N=C3Cl)N

Isomeric SMILES

C1=CC(C=C1)CN2C=NC3=C2N=C(N=C3Cl)N

InChI

InChI=1S/C11H10ClN5/c12-9-8-10(16-11(13)15-9)17(6-14-8)5-7-3-1-2-4-7/h1-4,6-7H,5H2,(H2,13,15,16)