2-chloranyl-9-cyclopentyl-N-ethyl-purin-6-amine; 3-methoxybicyclo[2.2.0]hexa-1(4),2,5-triene

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-ethyl-purin-6-amine; 3-methoxybicyclo[2.2.0]hexa-1(4),2,5-triene Openeye Name: 2-chloro-9-cyclopentyl-N-ethyl-purin-6-amine; 3-methoxybicyclo[2.2.0]hexa-1(4),2,5-triene CAS Name: 2-chloro-9-cyclopentyl-N-ethyl-6-purinamine; 3-methoxybicyclo[2.2.0]hexa-1(4),2,5-triene IUPAC Name: 2-chloro-9-cyclopentyl-N-ethylpurin-6-amine; 3-methoxybicyclo[2.2.0]hexa-1(4),2,5-triene Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-ethyl-amine; 3-methoxybicyclo[2.2.0]hexa-1(4),2,5-triene Formula: C19H22ClN5O MolecularWeight: 371.86388

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=C1N=CN2C3CCCC3)Cl.COC1=CC2=C1C=C2

Isomeric SMILES

CCNC1=NC(=NC2=C1N=CN2C3CCCC3)Cl.COC1=CC2=C1C=C2

InChI

InChI=1S/C12H16ClN5.C7H6O/c1-2-14-10-9-11(17-12(13)16-10)18(7-15-9)8-5-3-4-6-8;1-8-7-4-5-2-3-6(5)7/h7-8H,2-6H2,1H3,(H,14,16,17);2-4H,1H3